SCHEMBL11869249

SCHEMBL11869249

COC(=O)/C=C(C)/C=C/CCC(C)CCC=C(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.45
▸ TDP1 Q9NUW8 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ USP2 O75604 1/20 0.39
▸ GGPS1 O95749 2/20 0.36
▸ FDPS P14324 2/20 0.36
▸ TSHR P16473 1/20 0.35
▸ NFE2L2 Q16236 1/20 0.34
▸ GLA P06280 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 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
SCHEMBL11869252 1.00 ALOX15 (0.49) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11858941 0.90 ALDH1A1 (0.50) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11858937 0.90 ALDH1A1 (0.50) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11765273 0.84 LMNA (0.44) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11764961 0.84 LMNA (0.44) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11765270 0.84 LMNA (0.44) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11764966 0.84 LMNA (0.44) ALOX15ALDH1A1TDP1LMNACYP3A4
SCHEMBL11870541 0.83 ALOX15 (0.49) ALOX15ALDH1A1TDP1USP2GGPS1
SCHEMBL11870540 0.83 ALOX15 (0.49) ALOX15ALDH1A1TDP1USP2GGPS1
SCHEMBL11865737 0.81 CYP3A4 (0.50) ALOX15ALDH1A1TDP1LMNACYP3A4

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-3970704-A Alkoxy substituted aliphatic di-olefinic halides ZOECON CORPORATION (US) 1976-07-20 — — US disclosed
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