SCHEMBL15977665

SCHEMBL15977665

c1cncc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 10/20 0.71
CYP11B1 P15538 10/20 0.71
CYP19A1 P11511 7/20 0.71
CYP17A1 P05093 4/20 0.71
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
HSD17B1 P14061 1/20 0.47
CYP2B6 P20813 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B2 P37059 1/20 0.47
ERN1 O75460 1/20 0.47
CYP2A6 P11509 1/20 0.47
FGFR1 P11362 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 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
SCHEMBL10300977 0.99 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL15977618 0.97 CYP11B2 (0.68) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL10030070 0.97 CYP11B2 (0.71) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL23784950 0.96 CYP11B2 (0.66) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL12571836 0.96 CYP11B2 (0.65) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL26467391 0.96 CYP11B2 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL10030055 0.96 CYP11B2 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL10032221 0.93 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL24813343 0.92 CYP11B2 (0.61) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL24811996 0.92 CYP11B2 (0.60) CYP11B2CYP11B1CYP19A1CYP17A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed