SCHEMBL8029636

SCHEMBL8029636

CC(C)(CN1CCN(Cc2ccccc2)CC1)Oc1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.59
DRD4 P21917 1/20 0.52
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 2/20 0.48
MC4R P32245 1/20 0.47
NPC1 O15118 2/20 0.47
TP53 P04637 2/20 0.47
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
NR1I2 O75469 1/20 0.46
ADORA3 P0DMS8 1/20 0.46

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
SCHEMBL8020121 0.91 SIGMAR1 (0.56) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL8035713 0.86 MAPK1 (0.57) SIGMAR1DRD4ALDH1A1KDM4ENPC1
SCHEMBL8033351 0.85 SIGMAR1 (0.68) SIGMAR1ALDH1A1KDM4ERAB9AMEN1
SCHEMBL8031501 0.83 SIGMAR1 (0.52) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL8029632 0.82 SIGMAR1 (0.56) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL8033296 0.79 SIGMAR1 (0.52) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL8029641 0.78 ALDH1A1 (0.65) SIGMAR1ALDH1A1KDM4EPPARGPPARA
SCHEMBL18426823 0.76 SIGMAR1 (0.64) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL13036529 0.75 SIGMAR1 (0.69) SIGMAR1DRD4ALDH1A1KDM4EMC4R
SCHEMBL8033218 0.74 SIGMAR1 (0.49) SIGMAR1DRD4ALDH1A1KDM4EMC4R

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