SCHEMBL30634846

SCHEMBL30634846

OCCOc1ccc2cc(-c3cccc4ccccc34)ccc2c1-c1c(OCCO)ccc2cc(-c3cccc4ccccc34)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA7 P36544 1/20 0.44
SLC6A9 P48067 1/20 0.42
IDO1 P14902 1/20 0.42
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
PPARG P37231 8/20 0.41
PPARA Q07869 8/20 0.41
GPR84 Q9NQS5 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PPARD Q03181 1/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
MCL1 Q07820 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40

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
SCHEMBL29631695 1.00 ALOX5 (0.45) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL20774244 1.00 ALOX5 (0.45) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL31443121 0.99 ALOX5 (0.44) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL27113964 0.92 IDO1 (0.48) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL29601841 0.92 CHRNB4 (0.46) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL21858498 0.91 ALOX5 (0.46) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL28712372 0.90 IDO1 (0.42) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL29127416 0.90 IDO1 (0.46) ALOX5CHRNB4CHRNA3CHRNA7SLC6A9
SCHEMBL31443105 0.88 ALOX5 (0.44) ALOX5SLC6A9IDO1HTR1DHTR1B
SCHEMBL20774067 0.88 GPR84 (0.44) ALOX5IDO1HTR1DHTR1BGPR84

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3676239-B1 BINAPHTHYL COMPOUNDS REUTER CHEMISCHE APPBAU E K (DE) 2026-04-15 EP claimed
CN-111094223-B binaphthyl compounds 罗伊特化学仪器制造公司 2023-10-27 CN claimed
CN-111094223-B binaphthyl compounds 罗伊特化学仪器制造公司 2023-10-27 CN disclosed