SCHEMBL8029935

SCHEMBL8029935

CCCCCC(CN1CCN(Cc2ccccc2)CC1)Oc1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.59
LMNA P02545 2/20 0.48
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.44
HRH2 P25021 1/20 0.44

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
SCHEMBL8035801 0.92 NPC1 (0.46) SIGMAR1LMNAALDH1A1KDM4EMEN1
SCHEMBL8031421 0.89 SIGMAR1 (0.48) SIGMAR1LMNAALDH1A1KDM4EMEN1
SCHEMBL8033363 0.84 HRH3 (0.49) SIGMAR1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL8029639 0.84 SIGMAR1 (0.50) SIGMAR1LMNAALDH1A1KDM4EMEN1
SCHEMBL8029642 0.82 SIGMAR1 (0.54) SIGMAR1LMNAMAPK1ALDH1A1KDM4E
SCHEMBL8029877 0.82 SIGMAR1 (0.50) SIGMAR1MAPK1ALDH1A1KDM4EMEN1
SCHEMBL8029944 0.79 SIGMAR1 (0.53) SIGMAR1LMNAMAPK1HTTALDH1A1
SCHEMBL8031455 0.79 SIGMAR1 (0.53) SIGMAR1LMNAHTTALDH1A1KDM4E
SCHEMBL8020085 0.77 LMNA (0.59) SIGMAR1LMNAMAPK1ALDH1A1KDM4E
SCHEMBL28217942 0.76 SIGMAR1 (1.00) SIGMAR1LMNAALDH1A1KDM4EMEN1

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