SCHEMBL22602352

SCHEMBL22602352

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.50
▸ GGPS1 O95749 1/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ HDAC8 Q9BY41 3/20 0.41
▸ PRKDC P78527 3/20 0.39
▸ GABRP O00591 1/20 0.39
▸ GABRD O14764 1/20 0.39
▸ GABRA1 P14867 1/20 0.39
▸ GABRB1 P18505 1/20 0.39
▸ GABRG2 P18507 1/20 0.39
▸ GABRB3 P28472 1/20 0.39
▸ GABRA5 P31644 1/20 0.39
▸ GABRA3 P34903 1/20 0.39
▸ GABRA2 P47869 1/20 0.39
▸ GABRB2 P47870 1/20 0.39
▸ GABRA4 P48169 1/20 0.39
▸ GABRE P78334 1/20 0.39
▸ GABRA6 Q16445 1/20 0.39
▸ GABRG1 Q8N1C3 1/20 0.39

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
SCHEMBL22602602 0.85 ALOX5 (0.53) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL16532830 0.84 ALOX5 (0.59) ALOX5GGPS1HDAC8PRKDCGABRP
SCHEMBL17806984 0.84 ALOX5 (0.59) ALOX5GGPS1HDAC8PRKDCGABRP
SCHEMBL22602605 0.83 ALOX5 (0.48) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL17789231 0.83 ALOX5 (0.52) ALOX5GGPS1HDAC8PRKDCGABRP
SCHEMBL22155377 0.81 ALOX5 (0.57) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL22602360 0.81 ALOX5 (0.49) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL22602353 0.81 ALOX5 (0.46) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL437668 0.80 ALOX5 (0.53) ALOX5GGPS1NPC1RAB9AHDAC8
SCHEMBL22602357 0.79 ALOX5 (0.44) ALOX5GGPS1NPC1RAB9APRKDC

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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