SCHEMBL18905002

SCHEMBL18905002

c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccc4c(N(c5ccccc5)c5cccc6c5sc5ccccc56)ccc5ccc2c3c54)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.31
CYP1A2 P05177 1/20 0.31
FYN P06241 1/20 0.31
MAOA P21397 1/20 0.31
ACHE P22303 1/20 0.31
AHR P35869 1/20 0.31
ALOX5 P09917 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL25702764 0.94 CYP1A2 (0.36) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL12206482 0.91 CYP1A2 (0.36) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL30661197 0.91 GPR3 (0.34) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL18798599 0.91 GPR3 (0.34) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL2518112 0.91 GPR3 (0.34) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL18776332 0.90 CYP1A2 (0.36) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL24617944 0.87 ALOX5 (0.34) ALOX5
SCHEMBL24657790 0.87 NQO1 (0.35) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL21425114 0.87 MAPT (0.35) ALOX5ATML3MBTL1
SCHEMBL24154800 0.87 ALOX5 (0.36) CYP1A2ALOX5ATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210184119-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2021-06-17 US disclosed
US-20170155049-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed
US-20170155049-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed