SCHEMBL15460306

SCHEMBL15460306

c1ccc2c(-c3cc4sc5cc(-c6csc7ccccc67)c6ccccc6c5c4c4ccccc34)csc2c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
GPR3 P46089 1/20 0.41
ERN1 O75460 3/20 0.41
CYP2A6 P11509 3/20 0.40
APP P05067 2/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
CYP2C9 P11712 1/20 0.39
MAOB P27338 2/20 0.36
PRKDC P78527 1/20 0.36
MAOA P21397 1/20 0.36
ALDH1A1 P00352 1/20 0.35
KDM1A O60341 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
SCHEMBL15460360 0.87 CYP11B1 (0.37) MAPTERN1CYP2A6APPALDH1A1
SCHEMBL15460323 0.84 ERN1 (0.36) MAPTGPR3ERN1CYP2A6APP
SCHEMBL13408716 0.83 ERN1 (0.42) MAPTERN1CYP2A6APPCHRM2
SCHEMBL4381193 0.82 CYP2A6 (0.54) MAPTGPR3ERN1CYP2A6APP
SCHEMBL15460330 0.80 AHR (0.38) MAPTERN1APPCHRM2CHRM4
SCHEMBL15460249 0.80 PRKDC (0.40) MAPTERN1CYP2A6APPCHRM2
SCHEMBL15460256 0.78 ERN1 (0.41) MAPTGPR3ERN1CYP2A6APP
SCHEMBL15460329 0.77 MAPT (0.33) MAPTERN1APPCYP2C9MAOB
SCHEMBL17368369 0.74 PRKDC (0.33) GPR3ERN1CYP2A6APPCHRM2
SCHEMBL15460178 0.73 ERN1 (0.43) MAPTERN1CYP2A6APPCHRM2

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