SCHEMBL15460249

SCHEMBL15460249

c1ccc2c(-c3cc4oc5cc(-c6csc7ccccc67)c6ccccc6c5c4c4ccccc34)csc2c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.40
ERN1 O75460 3/20 0.40
ATM Q13315 1/20 0.40
CYP2A6 P11509 3/20 0.39
APP P05067 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
MAOB P27338 3/20 0.38
CYP2C9 P11712 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
ACVRL1 P37023 1/20 0.35
ACVR1 Q04771 1/20 0.35

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
SCHEMBL15460354 0.87 MAP3K7 (0.41) PRKDCATMCYP2A6MAOBACVRL1
SCHEMBL15460241 0.85 AHR (0.41) PRKDCERN1ATMCYP2A6APP
SCHEMBL15460232 0.84 PRKDC (0.39) PRKDCERN1ATMCYP2A6APP
SCHEMBL13408716 0.81 ERN1 (0.42) PRKDCERN1CYP2A6APPCHRM2
SCHEMBL4381193 0.80 CYP2A6 (0.54) ERN1CYP2A6APPCHRM2CHRM4
SCHEMBL15460306 0.80 MAPT (0.43) PRKDCERN1CYP2A6APPCHRM2
SCHEMBL15460178 0.79 ERN1 (0.43) PRKDCERN1ATMCYP2A6APP
SCHEMBL15460246 0.78 PRKDC (0.33) PRKDCERN1ATMAPPMAOB
SCHEMBL15460357 0.77 PRKDC (0.34) PRKDCERN1ATMCYP2A6APP
SCHEMBL15460352 0.77 PRKDC (0.36) PRKDCERN1ATMCYP2A6APP

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