SCHEMBL17849698

SCHEMBL17849698

CC1(C)c2cccc3ccc4cc(-c5ccc(-c6ccc(Br)cc6)cc5)cc1c4c23

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.34
MAOA P21397 1/20 0.34
LPL P06858 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
MCL1 Q07820 2/20 0.33
CYP2A6 P11509 1/20 0.32
TYMS P04818 1/20 0.31
PGR P06401 1/20 0.30
GUSB P08236 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
SCHEMBL13888836 1.00 MAOB (0.34) MAOBMAOALPLLIPGALDH1A1
SCHEMBL17849694 0.91 CYP2A6 (0.41) MAOBMAOALPLLIPGALDH1A1
SCHEMBL17849691 0.88 ALDH1A1 (0.48) LPLLIPGALDH1A1MAPK1MCL1
SCHEMBL17849711 0.83 BIRC5 (0.32) ALDH1A1
SCHEMBL12982875 0.82 NPSR1 (0.40) MAOAALDH1A1CYP2A6TYMS
SCHEMBL17849710 0.82 MEN1 (0.34) MAPK1
SCHEMBL15854456 0.81 LPL (0.35) LPLLIPGALDH1A1CYP2A6TYMS
SCHEMBL15907506 0.81 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL13888805 0.80 LPL (0.34) LPLLIPG
SCHEMBL17849683 0.80 LPL (0.34) LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed