SCHEMBL22602602

SCHEMBL22602602

CC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)cc(-c2cccc3c2oc2ccccc23)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.53
▸ GGPS1 O95749 1/20 0.46
▸ MAPT P10636 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ PRKDC P78527 3/20 0.41
▸ PTGES2 Q9H7Z7 1/20 0.40
▸ PLA2G2A P14555 1/20 0.39
▸ PLA2G4A P47712 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ TTR P02766 1/20 0.39
▸ SGK1 O00141 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ KMO O15229 1/20 0.38
▸ TNKS O95271 1/20 0.38
▸ PTGS2 P35354 1/20 0.38

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
SCHEMBL22602360 0.91 ALOX5 (0.49) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL22602620 0.88 ALOX5 (0.46) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL18199557 0.87 ALOX5 (0.63) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL22602357 0.86 ALOX5 (0.44) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL22602353 0.86 ALOX5 (0.46) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL22602605 0.85 ALOX5 (0.48) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL18199556 0.85 ALOX5 (0.61) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL1687976 0.85 ALOX5 (0.60) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL17974231 0.85 ALOX5 (0.60) ALOX5GGPS1MAPTSMN1; SMN2NPC1
SCHEMBL22602352 0.85 ALOX5 (0.50) ALOX5GGPS1MAPTSMN1; SMN2NPC1

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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