SCHEMBL11844978

SCHEMBL11844978

CC(C)=CCCC(C)CC=CC=CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ PPARA Q07869 1/20 0.39
▸ FNTA P49354 1/20 0.39
▸ FNTB P49356 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ GGPS1 O95749 2/20 0.35
▸ FDPS P14324 2/20 0.35
▸ ACHE P22303 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ NFE2L2 Q16236 1/20 0.34

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
SCHEMBL11844971 1.00 ALOX15 (0.45) ALOX15ALDH1A1PPARAFNTAFNTB
SCHEMBL523092 0.88 ALOX15 (0.49) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL1150423 0.88 ALOX15 (0.49) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL523093 0.88 ALOX15 (0.49) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL1150421 0.88 ALOX15 (0.49) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL11849438 0.83 ALOX15 (0.45) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL11842673 0.83 ALOX15 (0.45) ALOX15ALDH1A1USP2TSHRGGPS1
SCHEMBL7933532 0.83 ALOX15 (0.50) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL7933530 0.83 ALOX15 (0.50) ALOX15ALDH1A1FNTAFNTBUSP2
SCHEMBL9578905 0.83 ALOX15 (0.50) ALOX15ALDH1A1FNTAFNTBUSP2

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-3966780-A PESTICIDES, INSECTICIDES HOFFMANN-LA ROCHE INC. (US) 1976-06-29 — — US disclosed
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