SCHEMBL26645976

SCHEMBL26645976

C1=Cc2c(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)cc3c(oc4ccccc43)c2CC1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 2/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ PRMT5 O14744 1/20 0.30
▸ WDR77 Q9BQA1 1/20 0.30

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
SCHEMBL23430598 0.83 ALOX5 (0.32) PRKDCALOX5
SCHEMBL12985038 0.82 CYP1A1 (0.32) CYP1A1CYP1B1NPC1CYP1A2CYP2C9
SCHEMBL26230975 0.81 NPC1 (0.33) ALOX5CYP1A1CYP1B1NPC1CYP1A2
SCHEMBL10122648 0.81 ALOX5 (0.43) PRKDCALOX5CYP1A1CYP1B1GPR84
SCHEMBL17399884 0.80 NPC1 (0.31) CYP1A1CYP1B1NPC1CYP1A2CYP2C9
SCHEMBL20363789 0.79 CYP1A1 (0.33) PRKDCCYP1A1CYP1B1
SCHEMBL24236562 0.79 CYP1A1 (0.36) PRKDCCYP1A1CYP1B1GPR84
SCHEMBL25452910 0.78 ALOX5 (0.34) PRKDCALOX5PRMT5WDR77
SCHEMBL10122603 0.78 GPR84 (0.38) PRKDCALOX5CYP1A1CYP1B1GPR84
SCHEMBL26224989 0.78 ALOX5 (0.32) PRKDCALOX5GPR84

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
US-20230345749-A1 QUANTUM DOT, METHOD OF PREPARING THE SAME, AND INK COMPOSITION, LIGHT-EMITTING DEVICE, OPTICAL MEMBER, AND APPARATUS INCLUDING THE QUANTUM DOT SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-26 — — US disclosed
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