SCHEMBL22602353

SCHEMBL22602353

CC(=O)c1cc(-c2cncnc2)cc(-c2cccc3c2oc2ccccc23)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.46
▸ GGPS1 O95749 1/20 0.40
▸ PRKDC P78527 5/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ PTGES2 Q9H7Z7 1/20 0.36
▸ RXFP1 Q9HBX9 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34

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
SCHEMBL22602357 0.89 ALOX5 (0.44) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL22602602 0.86 ALOX5 (0.53) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL24493113 0.85 ALOX5 (0.51) ALOX5GGPS1PRKDCMAPTPTGES2
SCHEMBL22602360 0.84 ALOX5 (0.49) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL22428496 0.83 ALOX5 (0.49) ALOX5GGPS1PRKDCPTGES2PIK3CD
SCHEMBL14718359 0.81 ALOX5 (0.56) ALOX5GGPS1PRKDCPTGES2PIK3CD
SCHEMBL22602605 0.81 ALOX5 (0.48) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL22602620 0.81 ALOX5 (0.46) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL22602352 0.81 ALOX5 (0.50) ALOX5GGPS1PRKDCNPC1RAB9A
SCHEMBL24492892 0.79 ALOX5 (0.45) ALOX5GGPS1PRKDCRAB9APTGES2

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-2020218648-A1 PHENANTHROLINE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 진웅산업 2020-10-29 — — WO disclosed
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