SCHEMBL26950482

SCHEMBL26950482

c1ccc2cc(-c3c4ccccc4c(-c4cccc5cc(-c6ccc7c(-c8c9ccccc9c(-c9ccc(-c%10cccc%11c%10oc%10ccccc%10%11)cc9)c9ccccc89)cccc7c6)ccc45)c4ccccc34)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.48
PRKDC P78527 6/20 0.39
GGPS1 O95749 1/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
PTGES2 Q9H7Z7 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
ATM Q13315 1/20 0.33
PIM1 P11309 1/20 0.33

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
SCHEMBL26950314 0.96 ALOX5 (0.44) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL26950243 0.95 ALOX5 (0.47) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL22088312 0.94 ALOX5 (0.46) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL12577636 0.94 ALOX5 (0.47) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL26950480 0.94 ALOX5 (0.46) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL26949651 0.93 ALOX5 (0.48) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL12577659 0.93 ALOX5 (0.50) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL12577663 0.93 ALOX5 (0.50) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL24285542 0.93 ALOX5 (0.49) ALOX5PRKDCGGPS1CYP1A1CYP1B1
SCHEMBL26950086 0.93 ALOX5 (0.52) ALOX5PRKDCGGPS1CYP1A1CYP1B1

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-2023239193-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 WO disclosed