SCHEMBL6039609

SCHEMBL6039609

NCC(N)(Cc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 2/20 0.43
SLC6A2 P23975 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
KIF11 P52732 2/20 0.36
MMP8 P22894 1/20 0.35
GHSR Q92847 1/20 0.34
TSHR P16473 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
KEAP1 Q14145 1/20 0.34
HTR1B P28222 1/20 0.34
CA12 O43570 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29440057 1.00 ACP3 (0.43) ACP3SLC6A2TAAR1LOXL2SMN1; SMN2
SCHEMBL1465980 0.74 ALDH1A1 (0.41) ACP3SLC6A2TAAR1KIF11TSHR
SCHEMBL11647115 0.74 ACP3 (0.39) ACP3SLC6A2TAAR1SMN1; SMN2HIF1A
SCHEMBL5010732 0.72 ACP3 (0.42) ACP3SLC6A2TAAR1HIF1AKIF11
SCHEMBL9584692 0.72 TAAR1 (0.50) SLC6A2TAAR1LOXL2SMN1; SMN2HIF1A
SCHEMBL1780460 0.72 ALDH1A1 (0.39) TAAR1KIF11TSHRALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL7677659 0.71 TAAR1 (0.48) SLC6A2TAAR1LOXL2SMN1; SMN2HIF1A
SCHEMBL7853160 0.71 TAAR1 (0.48) SLC6A2TAAR1KIF11TSHRALDH1A1
SCHEMBL28289370 0.70 ACP3 (0.40) ACP3SLC6A2TAAR1KIF11MMP8
SCHEMBL29024914 0.69 ALDH1A1 (0.48) ACP3HIF1AKIF11TSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060014242-A1 Methods of modifying feeding behavior, compounds useful in such methods, and DNA encoding a hypothalamic atypical neuropeptide Y/peptide YY receptor (Y5) GERALD CHRISTOPHE P 2006-01-19 US disclosed
US-6818445-B2 ADMINISTERING COUMPOUNDS SUCH AS AROMATIC ALKYL DIAMINE DERIVATIVES AS Y5 RECEPTOR AGONIST OR ANTAGONIST TO INCREASE OR DECREASE FOOD CONSUMPTION SYNAPTIC PHARMACEUTICAL CORPORATION 2004-11-16 US disclosed
US-6713265-B1 MEASURING THE BINDING OF GTP GAMMA S TO CELLS EXPRESSING Y5 RECEPTOR IN THE PRESENCE AND IN THE ABSENCE OF COMPOUND OF INTEREST SYNAPTIC PHARMACEUTICAL CORPORATION 2004-03-30 US disclosed
US-20040053864-A1 Methods and compositions for control of bone formation via modulation of neuropeptide y activity BAYLOR COLLEGE OF MEDICINE 2004-03-18 US disclosed
EP-1382616-A2 Pharmaceutical composition for use in the treatment of abnormalities associated with the activity of a human Y5-receptor SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2004-01-21 EP disclosed
US-6645774-B1 Administering for treatment of obesity, bulimia or anorexia SYNAPTIC PHARMACEUTICAL CORPORATION 2003-11-11 US disclosed
EP-0732875-B1 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMA CORP (US) 2003-07-02 EP disclosed
US-20020103123-A1 Methods of modifying feeding behavior, compounds useful in such methods, and DNA encoding a hypothalamic atypical neuropeptide Y/peptide YY receptor (Y5) SYNAPTIC PHARMACEUTICAL CORPORATION 2002-08-01 US disclosed
EP-1007073-A4 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMA CORP (US) 2002-03-27 EP disclosed
US-6316203-B1 MONITORING ACTIVITY OF NERVOUS SYSTEM LIGAND; INCUBATE LIGAND AND TRANSFECTED CELL, DETECT AMPLIFICATION IN BINDING PROTEIN ACTIVITY, AMPLIFICATION IN BINDING PROTEIN ACTIVITY INDICATES AGONIST SYNAPTIC PHARMACEUTICAL CORPORATION 2001-11-13 US disclosed
WO-2001053477-A1 METHODS AND COMPOSITIONS FOR CONTROL OF BONE FORMATION VIA MODULATION OF NEUROPEPTIDE Y ACTIVITY BAYLOR COLLEGE OF MEDICINE (US) 2001-07-26 WO disclosed
EP-1007073-A1 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-06-14 EP disclosed
US-5989920-A RECEPTOR BINDING ASSAY FOR SCREENING DRUGS WHICH BIND TO HUMAN OR RAT Y5 RECEPTOR BY CONTACTING NONNEURONAL CELLS TRANSFECTED WITH VECTOR HAVING SEQUENCE CODING FOR RECEPTOR AND DETECTING BINDING; TREATMENT OF OBESITY, EATING DISORDERS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1999-11-23 US disclosed
US-5968819-A FOR MODIFYING FEEDING BEHAVIOR IN CONNECTION WITH EATING DISORDERS; FOR SCREENING ANTAGONISTS, AGONISTS; FOR PROBES TO DETECT RECEPTORS; ANTISENSE AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1999-10-19 US disclosed
WO-1997046250-A1 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-12-11 WO disclosed
EP-0732875-A4 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMA CORP (US) 1997-02-26 EP disclosed
EP-0732875-A1 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1996-09-25 EP disclosed
WO-1996016542-A1 METHODS OF MODIFYING FEEDING BEHAVIOR, COMPOUNDS USEFUL IN SUCH METHODS, AND DNA ENCODING A HYPOTHALAMIC ATYPICAL NEUROPEPTIDE Y/PEPTIDE YY RECEPTOR (Y5) SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1996-06-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020103123-A1 Methods of modifying feeding behavior, compounds useful in such methods, and DNA encoding a hypothalamic atypical neuropeptide Y/peptide YY receptor (Y5) NPY5R, NPY4R, NPY1R ACP3 1508/4885SLC6A2 716/4885TAAR1 167/4885
US-20060014242-A1 Methods of modifying feeding behavior, compounds useful in such methods, and DNA encoding a hypothalamic atypical neuropeptide Y/peptide YY receptor (Y5) NPY5R, NPY4R, NPY1R ACP3 1502/4885SLC6A2 707/4885TAAR1 178/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.