SCHEMBL15460264

SCHEMBL15460264

c1ccc2c(-c3cc4c5cc(-c6csc7ccccc67)c6cnccc6c5sc4c4ccncc34)csc2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
MAP3K7 O43318 4/20 0.37
TAB1 Q15750 4/20 0.37
PTGER2 P43116 4/20 0.36
CYP2A6 P11509 1/20 0.35
CYP17A1 P05093 1/20 0.35
CYP1A2 P05177 1/20 0.35
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM1A O60341 1/20 0.34
ERN1 O75460 1/20 0.34
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33
APP P05067 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL15460256 0.87 ERN1 (0.41) CYP2A6ALDH1A1KDM1AERN1APP
SCHEMBL15460360 0.83 CYP11B1 (0.37) CYP11B1CYP11B2MAP3K7TAB1PTGER2
SCHEMBL15460182 0.82 MAP3K7 (0.43) CYP11B1CYP11B2MAP3K7TAB1PTGER2
SCHEMBL15460268 0.81 ALOX5 (0.45) CYP17A1CYP1A2ALDH1A1RAB9ACCNC
SCHEMBL15460354 0.80 MAP3K7 (0.41) CYP11B1CYP11B2MAP3K7TAB1PTGER2
SCHEMBL15460280 0.74 CYP2A6 (0.38) CYP2A6ALDH1A1ERN1APPHPGD
SCHEMBL15460263 0.72 CYP11B1 (0.49) CYP11B1CYP11B2CYP2A6CYP17A1CYP1A2
SCHEMBL4381193 0.71 CYP2A6 (0.54) CYP2A6ALDH1A1KDM1AERN1APP
SCHEMBL21180556 0.70 MAP3K7 (0.36) CYP11B1CYP11B2MAP3K7TAB1PTGER2
SCHEMBL21295936 0.70 CYP2A6 (0.47) CYP11B1CYP11B2PTGER2CYP2A6CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9385327-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-05 US disclosed
US-9385327-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-05 US disclosed
US-9349966-B2 2016-05-24 US disclosed
US-9349966-B2 2016-05-24 US disclosed
US-20140034915-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO. LTD. (KR) 2014-02-06 US disclosed
US-20140034915-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO. LTD. (KR) 2014-02-06 US disclosed