SCHEMBL8020124

SCHEMBL8020124

CC(C)CN1CCN(Cc2ccccc2)CC1.c1ccc2c(c1)O2

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.56
MC4R P32245 1/20 0.53
KDM4E B2RXH2 3/20 0.53
LMNA P02545 2/20 0.51
POLB P06746 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.48
DRD4 P21917 1/20 0.47
IGF1R P08069 1/20 0.47
CYP2D6 P10635 1/20 0.47
ACHE P22303 1/20 0.46
HTR1A P08908 1/20 0.46
HTT P42858 1/20 0.46
GAA P10253 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
SCHEMBL1126489 0.90 SIGMAR1 (0.69) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL1394535 0.77 KDM4E (0.68) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL1394539 0.77 KDM4E (0.68) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL1394677 0.77 KDM4E (0.68) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL23775274 0.77 SIGMAR1 (0.64) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL24672242 0.77 KDM4E (0.68) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL8446786 0.77 SIGMAR1 (0.64) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL8446462 0.77 SIGMAR1 (0.64) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL21797152 0.77 KDM4E (0.68) SIGMAR1MC4RKDM4ELMNAPOLB
SCHEMBL10885924 0.77 SIGMAR1 (0.64) SIGMAR1MC4RKDM4ELMNAPOLB

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 2 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
EP-0702010-A1 Benzopyranderivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-03-20 EP disclosed