SCHEMBL7269544

SCHEMBL7269544

N#CCCc1cccc2c1OCO2

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.43
EED O75530 2/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 4/20 0.40
TSHR P16473 4/20 0.40
MAPK1 P28482 4/20 0.40
HSD17B10 Q99714 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ALOX15 P16050 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
KDM4C Q9H3R0 1/20 0.40
MTNR1A P48039 6/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
HTR2C P28335 1/20 0.37
FAAH O00519 1/20 0.36

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
SCHEMBL9231118 0.82 TSHR (0.43) HTR2AEEDMEN1KMT2AALDH1A1
SCHEMBL12606365 0.81 MEN1 (0.39) MEN1KMT2A
SCHEMBL7519080 0.79 MTNR1A (0.53) KDM4EMTNR1A
SCHEMBL3243511 0.77 MTNR1A (0.45) HTR2AEEDMEN1KMT2AALDH1A1
SCHEMBL30360690 0.77 KDM4C (0.46) HTR2AEEDALDH1A1HPGDMAPK1
SCHEMBL4130192 0.77 KDM4C (0.46) HTR2AEEDALDH1A1HPGDMAPK1
SCHEMBL8096405 0.77 EED (0.44) HTR2AEEDLMNAKDM4CMTNR1A
SCHEMBL1010010 0.77 TAAR1 (0.46) HTR2AEEDKDM4CMTNR1AABCG2
SCHEMBL11044001 0.77 EED (0.44) HTR2AEEDLMNAKDM4CMTNR1A
SCHEMBL7771835 0.77 KDM4C (0.46) HTR2AEEDALDH1A1HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457686-B1 Novel aminopiperidine, aminopyrrolidine and aminoperhydroazepine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1994-08-03 EP disclosed
US-5214055-A Analgesics, psychological disorders, anxiolytic agents ADIR ET COMPAGNIE (FR) 1993-05-25 US disclosed
US-5189045-A Antiserotonine agent ADIR ET COMPAGNIE (FR) 1993-02-23 US disclosed
US-5134147-A Antipsychotic agents ADIR ET COMPAGNIE (FR) 1992-07-28 US disclosed
US-5100902-A Dopamine and Serotonin Antagonists, Antipsychotic Agents ADIR ET COMPAGNIE (FR) 1992-03-31 US disclosed
EP-0457686-A1 Novel aminopiperidine, aminopyrrolidine and aminoperhydroazepine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1991-11-21 EP disclosed