SCHEMBL8035720

SCHEMBL8035720

CCCCC(Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
PPARG P37231 2/20 0.49
ALDH1A1 P00352 2/20 0.49
PPARA Q07869 1/20 0.49
MAPK1 P28482 2/20 0.47
PKM P14618 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
PTGES O14684 1/20 0.43
ALOX5 P09917 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
CACNA1G O43497 1/20 0.43

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
SCHEMBL8031463 0.89 ALDH1A1 (0.55) FAAHSMN1; SMN2ALDH1A1MAPK1PKM
SCHEMBL8029869 0.85 ALDH1A1 (0.53) FAAHSMN1; SMN2ALDH1A1MAPK1PKM
SCHEMBL8029944 0.84 SIGMAR1 (0.53) FAAHSMN1; SMN2ALDH1A1MAPK1PKM
SCHEMBL5059944 0.83 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL8020002 0.83 SMN1; SMN2 (0.53) FAAHSMN1; SMN2PPARGALDH1A1PPARA
SCHEMBL8033220 0.82 ALDH1A1 (0.58) FAAHSMN1; SMN2ALDH1A1MAPK1PKM
SCHEMBL8020084 0.81 FAAH (0.54) FAAHSMN1; SMN2ALDH1A1MAPK1SIGMAR1
SCHEMBL8029877 0.81 SIGMAR1 (0.50) FAAHSMN1; SMN2PPARGALDH1A1PPARA
SCHEMBL8035728 0.81 HRH3 (0.50) FAAHSMN1; SMN2ALDH1A1PPARAMAPK1
SCHEMBL5134366 0.80 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0702010-B1 Benzopyranderivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-03-15 EP disclosed
US-5691340-A CENTRAL NERVOUS SYSTEM DISORDERS, STROKES, CARDIOVASCULAR DISORDERS, ALZHEIMER*S DISEASE OR ANTIINFLAMMATORY AGENTS ADIR ET COMPAGNIE (FR) 1997-11-25 US disclosed
US-5668138-A AFFINITY FOR SIGMA RECEPTORS, CENTRAL NERVOUS SYSTEM DISORDERS ADIR ET COMPAGNIE (FR) 1997-09-16 US disclosed
EP-0702010-A1 Benzopyranderivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-03-20 EP disclosed