SCHEMBL7205665

SCHEMBL7205665

Cc1cc(N(CCCN2CCN(c3ccccc3)CC2)OC(=O)/C=C/C(=O)ON(CCCN2CCN(c3ccccc3)CC2)c2cc(C)c3ccccc3n2)nc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 10/20 0.46
HTR1A P08908 7/20 0.46
OPRM1 P35372 1/20 0.44
LMNA P02545 4/20 0.44
MAPT P10636 3/20 0.44
GFER P55789 2/20 0.44
POLB P06746 1/20 0.44
TP53 P04637 1/20 0.44
PARP1 P09874 1/20 0.43
SLC6A4 P31645 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DRD3 P35462 2/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL7205499 0.90 HTR2A (0.48) HTR7HTR1ASLC6A4ALDH1A1DRD3
SCHEMBL7212903 0.88 PARP1 (0.50) HTR7HTR1APARP1KDM4EALDH1A1
SCHEMBL7205490 0.74 DRD2 (0.58) HTR7HTR1ADRD3HTR2AHTR2C
Fumaric Acid SCHEMBL7205663 0.73 LMNA (0.51) HTR7HTR1ALMNAMAPTGFER
Fumaric Acid SCHEMBL7205669 0.73 LMNA (0.51) HTR7HTR1ALMNAMAPTGFER
SCHEMBL7899645 0.65 HTR1A (0.50) HTR7HTR1ADRD3HTR2AHRH3
SCHEMBL6509689 0.64 KMT2A (0.78) LMNAMAPTGFERPOLBKDM4E
Fumaric Acid SCHEMBL10704726 0.64 KCNH2 (0.52) HTR7HTR1AOPRM1DRD3HTR2A
SCHEMBL4494415 0.63 HTR1A (0.60) HTR7HTR1ALMNAGFERHTR2A
SCHEMBL1727889 0.62 HTR2A (0.51) HTR7HTR1AOPRM1LMNAGFER

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613901-B2 For therapy and prophylaxis of neuropsychochological disorders such as schizophrenia and other central nervous system diseases NEUROGEN CORPORATION 2003-09-02 US claimed
US-20020143019-A1 2-aminoalkylaminoquinolines as dopamine D4 ligands NEUROGEN CORPORATION 2002-10-03 US claimed
EP-0991642-A1 2-AMINOALKYLAMINOQUINOLINES AS DOPAMINE D4 LIGANDS NEUROGEN CORPORATION (US) 2000-04-12 EP claimed
WO-1998056786-A1 2-AMINOALKYLAMINOQUINOLINES AS DOPAMINE D4 LIGANDS NEUROGEN CORPORATION (US) 1998-12-17 WO claimed
US-6613901-B2 For therapy and prophylaxis of neuropsychochological disorders such as schizophrenia and other central nervous system diseases NEUROGEN CORPORATION 2003-09-02 US disclosed
US-20020143019-A1 2-aminoalkylaminoquinolines as dopamine D4 ligands NEUROGEN CORPORATION 2002-10-03 US disclosed
US-6313141-B1 FOR THERAPY OF SCHIZOPHRENIA, PSYCHOTIC DEPRESSION, MANIA, PARKINSON'S DISEASE AND TARDIVE DISKINESIA NEUROGEN CORPORATION 2001-11-06 US disclosed
EP-0991642-A1 2-AMINOALKYLAMINOQUINOLINES AS DOPAMINE D4 LIGANDS NEUROGEN CORPORATION (US) 2000-04-12 EP disclosed
US-5972945-A FOR TREATING PSYCHOTIC DISORDERS SUCH AS SCHIZOPHRENIA AND OTHER CENTRAL NERVOUS SYSTEM DISEASES NEUROGEN CORPORATION (US) 1999-10-26 US disclosed
WO-1998056786-A1 2-AMINOALKYLAMINOQUINOLINES AS DOPAMINE D4 LIGANDS NEUROGEN CORPORATION (US) 1998-12-17 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 (1 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-20020143019-A1 2-aminoalkylaminoquinolines as dopamine D4 ligands SLC6A3, DRD4, ADRA2C HTR7 102/4885HTR1A 44/4885OPRM1 16/4885

“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.