SCHEMBL20062900

SCHEMBL20062900

COc1ccc2c(c1)N(c1cccnc1)/C(=C1\N(c3cccnc3)c3ccc(OC)cc3N1c1cccnc1)N2c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 9/20 0.46
CYP11B1 P15538 7/20 0.46
CYP17A1 P05093 4/20 0.46
CYP19A1 P11511 3/20 0.46
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.42
GFER P55789 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP3A4 P08684 2/20 0.40
HTT P42858 1/20 0.40
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
ELANE P08246 1/20 0.39
AR P10275 1/20 0.38

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
SCHEMBL20681872 0.78 MAPT (0.47) CYP11B2CYP11B1CYP17A1CYP19A1MAPT
SCHEMBL20062884 0.78 CYP2A6 (0.50) CYP11B2MAPTALDH1A1CYP3A4HTT
SCHEMBL20062887 0.77 HTT (0.56) CYP11B2MAPTNPC1RAB9AALDH1A1
SCHEMBL20062895 0.77 ALDH1A1 (0.44) CYP19A1MAPTNPC1RAB9AALDH1A1
SCHEMBL20062904 0.72 TDP1 (0.47) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL20062891 0.71 HTT (0.50) CYP11B1CYP19A1MAPTKDM4ENPC1
SCHEMBL29500368 0.69 DRD1 (0.51) CYP11B2CYP11B1CYP19A1KDM4EGFER
SCHEMBL17731528 0.68 CYP11B2 (0.49) CYP11B2CYP11B1CYP17A1CYP19A1MAPT
SCHEMBL19343005 0.67 CYP1A2 (0.55) CYP11B2CYP11B1KDM4ENPC1RAB9A
SCHEMBL162478 0.65

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed