SCHEMBL8031464

SCHEMBL8031464

CCC(C)c1ccc(OC(C)C(=O)N2CCN(Cc3ccccc3)CC2)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
HTT P42858 4/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MAPT P10636 1/20 0.52
ALOX12 P18054 1/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPK1 P28482 2/20 0.49
APOBEC3A P31941 2/20 0.48
APOBEC3G Q9HC16 2/20 0.48
FAAH O00519 1/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 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
SCHEMBL8035734 0.91 SMN1; SMN2 (0.55) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL8035755 0.84 KDM4E (0.45) LMNASMN1; SMN2HTTMAPTALOX12
SCHEMBL8031475 0.79 APOBEC3A (0.56) LMNASMN1; SMN2HTTNPSR1MEN1
SCHEMBL8033304 0.77 ALDH1A1 (0.63) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL8029605 0.76 MEN1 (0.58) SMN1; SMN2HTTMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL8889528 0.76 KMT2A (0.63) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL8029885 0.76 ALDH1A1 (0.55) LMNASMN1; SMN2HTTMAPTMEN1
SCHEMBL8033271 0.74 KDM4E (0.48) LMNAHTTMEN1KMT2AALDH1A1
SCHEMBL8029862 0.74 SMN1; SMN2 (0.58) LMNASMN1; SMN2HTTMEN1KMT2A
SCHEMBL16026512 0.74 ALDH1A1 (0.67) LMNASMN1; SMN2HTTNPSR1MAPT

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