SCHEMBL8035752

SCHEMBL8035752

CCC(Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.55
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 1/20 0.51
SIGMAR1 Q99720 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 2/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
LMNA P02545 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ATM Q13315 1/20 0.46
TRPV4 Q9HBA0 1/20 0.46
MCHR1 Q99705 1/20 0.46
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
FAAH O00519 1/20 0.45

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
SCHEMBL8020077 0.82 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL8029589 0.82 TSHR (0.61) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL8887455 0.81 TSHR (0.60) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL25295840 0.81 ALDH1A1 (0.59) PPARANPC1RAB9ARXFP1SMN1; SMN2
SCHEMBL8033345 0.79 PPARG (0.48) SMN1; SMN2ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL8035809 0.79 SIGMAR1 (0.53) PPARAALDH1A1SIGMAR1KMT2ALMNA
SCHEMBL5064012 0.78 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL8033255 0.78 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1MEN1KMT2APOLB
SCHEMBL8035824 0.77 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL8887841 0.77 PPARA (0.48) PPARASIGMAR1MEN1KMT2APTGDR2

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