SCHEMBL8556355

SCHEMBL8556355

CC1(C)CC(=O)N(CCCCBr)C(=O)C1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.55
DRD2 P14416 3/20 0.55
HTR7 P34969 2/20 0.55
HTR2C P28335 1/20 0.55
HRH1 P35367 1/20 0.55
HTR2B P41595 1/20 0.55
HTR2A P28223 2/20 0.49
DRD3 P35462 1/20 0.48

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
SCHEMBL9441283 0.98 HTR1A (0.54) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL9441347 0.98 HTR1A (0.54) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL11085047 0.81 HTR1A (0.39) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL11079247 0.81 HTR1A (0.39) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL8887121 0.81 HTR1A (0.55) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL9120002 0.81 HTR1A (0.55) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL9120391 0.79 HTR1A (0.54) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL9119061 0.78 HTR1A (0.53) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL7304949 0.78 HTR1A (0.52) HTR1ADRD2HTR7HTR2CHRH1
SCHEMBL10973154 0.77 FAAH (0.46) HTR1AHTR7

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180193330-A1 ALKYLATED TETRAHYDROISOQUINOLINES FOR BINDING TO CENTRAL NERVOUS SYSTEM RECEPTORS FLORIDA A&M UNIVERSITY 2018-07-12 US disclosed
EP-0564358-B1 3-aminochromane spiro derivatives, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-11-04 EP disclosed
EP-0422134-B1 5-HT SELECTIVE AGENTS ABBOTT LAB (US) 1996-06-12 EP disclosed
US-5510374-A USEFUL IN TREATMENT OF DISORDERS OF THE SEROTINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1996-04-23 US disclosed
EP-0548664-B1 2,3,3a-5,9b-hexahydro-1H-benzo(e)indole derivatives HOFFMANN LA ROCHE (CH) 1995-05-31 EP disclosed
US-5420150-A Antidepressants and treatment of anxiety GUILLAUMET GERALD (FR) 1995-05-30 US disclosed
US-5397783-A Antidepressants, anxiolytic agents ADIR ET COMPAGNIE (FR) 1995-03-14 US disclosed
US-5376661-A Psychological disorders ADIR ET COMPAGNIE (FR) 1994-12-27 US disclosed
US-5346916-A FOR TREATING ANIMALS SUFFERING FROM DISORDERS OF THE SEROTONINERGIC SYSTEM ADIR ET COMPAGNIE (FR) 1994-09-13 US disclosed
EP-0452204-B1 3-Aminochromane derivatives, procedure for their preparation and pharmaceutical compositions containing them ADIR (FR) 1994-06-15 EP disclosed
US-5049564-A Hypotensive, 5-hydroxytryptamine ABBOTT LABORATORIES (US) 1991-09-17 US disclosed
WO-1991004973-A1 INDOLE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-04-18 WO disclosed
EP-0422134-A1 5-HT SELECTIVE AGENTS. ABBOTT LAB (US) 1991-04-17 EP disclosed
WO-1990006927-A1 5-HT SELECTIVE AGENTS ABBOTT LABORATORIES (US) 1990-06-28 WO disclosed
US-4892879-A 1-substituted-4-(thiazolyl-2-)-piperazines, -piperidines and tetrahydro-pyridines useful as anxioltic, psychogeriatric, antisepressant and antischiziphrenic agents SANDOZ PHARM. CORP. (US) 1990-01-09 US disclosed
US-4737500-A 1-substituted-4-(thiazolyl-2-)-piperazines, -piperidines and -tetrahydropyridines useful as anxiolytic, psychogeriatric, antidepressant and antischizophrenic agents SANDOZ PHARM. CORP. (US) 1988-04-12 US disclosed
US-4452799-A NEUROLEPTIC AGENTS MEAD JOHNSON & COMPANY (US) 1984-06-05 US disclosed
US-4423049-A TRANQUILIZERS MEAD JOHNSON & COMPANY (US) 1983-12-27 US disclosed
US-4411901-A ANTIPSYCHOTICS MEAD JOHNSON & COMPANY (US) 1983-10-25 US disclosed
US-4361565-A PSYCHOTROPIC PROPERTIES MEAD JOHNSON & COMPANY (US) 1982-11-30 US 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-20180193330-A1 ALKYLATED TETRAHYDROISOQUINOLINES FOR BINDING TO CENTRAL NERVOUS SYSTEM RECEPTORS NTSR2, HTR3B, NTSR1 HTR1A 28/4885DRD2 226/4885HTR7 21/4885

“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.