SCHEMBL8031456

SCHEMBL8031456

CCCC(C)(Oc1ccc(Cl)cc1)C(=O)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.55
PPARA Q07869 1/20 0.55
LMNA P02545 3/20 0.54
POLB P06746 1/20 0.54
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 3/20 0.52
PKM P14618 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 3/20 0.50
MEN1 O00255 2/20 0.50
FAAH O00519 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
SIGMAR1 Q99720 1/20 0.47

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
SCHEMBL8033201 0.93 ALDH1A1 (0.56) LMNAALDH1A1KMT2APKMMAPK1
SCHEMBL8029641 0.85 ALDH1A1 (0.65) PPARGPPARALMNAPOLBALDH1A1
SCHEMBL8035787 0.80 FAAH (0.54) LMNAPOLBALDH1A1KMT2APKM
SCHEMBL8031501 0.78 SIGMAR1 (0.52) PPARGPPARALMNAALDH1A1KMT2A
SCHEMBL8020083 0.78 ALDH1A1 (0.63) PPARALMNAALDH1A1KMT2APKM
SCHEMBL8033286 0.76 PKM (0.67) LMNAPOLBALDH1A1KMT2APKM
SCHEMBL3102154 0.74 PPARA (0.64) PPARGPPARALMNAALDH1A1KMT2A
SCHEMBL8186898 0.74 ALDH1A1 (0.74) LMNAALDH1A1KMT2AMAPK1KDM4E
SCHEMBL8029636 0.74 SIGMAR1 (0.59) PPARGPPARALMNAPOLBALDH1A1
SCHEMBL8031485 0.73 FAAH (0.61) LMNAPOLBALDH1A1KMT2APKM

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 3 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-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