SCHEMBL21433059

SCHEMBL21433059

c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc(-c4cccc5c4sc4c(-c6cccc7c6oc6ccccc67)cccc45)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.43
▸ PLA2G2A P14555 3/20 0.36
▸ PLA2G4A P47712 3/20 0.36
▸ PRKDC P78527 9/20 0.36
▸ GGPS1 O95749 1/20 0.36
▸ LIMK1 P53667 1/20 0.34
▸ PLA2G10 O15496 1/20 0.34
▸ PTGES2 Q9H7Z7 1/20 0.34
▸ PIK3CD O00329 2/20 0.32
▸ PIK3CB P42338 2/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ BRDT Q58F21 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31

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
SCHEMBL21433057 0.98 ALOX5 (0.46) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL21907404 0.96 ALOX5 (0.43) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL21432779 0.96 ALOX5 (0.43) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL17703046 0.95 ALOX5 (0.49) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL21432976 0.92 ALOX5 (0.41) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL19605097 0.91 ALOX5 (0.42) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL17057228 0.91 ALOX5 (0.52) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL21433061 0.91 ALOX5 (0.40) ALOX5PRKDCGGPS1LIMK1PTGES2
SCHEMBL17703042 0.89 ALOX5 (0.42) ALOX5PLA2G2APLA2G4APRKDCGGPS1
SCHEMBL19607080 0.89 ALOX5 (0.44) ALOX5PLA2G2APLA2G4APRKDCGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019190272-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 동진쎄미켐 2019-10-03 — — WO disclosed
Send feedback