SCHEMBL11764082

SCHEMBL11764082

COC(=O)/C=C(C)/C=C/CC(C)CCCCCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ PTPN1 P18031 1/20 0.34
▸ KDM1A O60341 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.31
▸ KDM4C Q9H3R0 2/20 0.31
▸ KDM4A O75164 1/20 0.31
▸ PHF8 Q9UPP1 1/20 0.31
▸ KDM2A Q9Y2K7 1/20 0.31

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
SCHEMBL11764084 1.00 LMNA (0.56) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL7570647 0.96 LMNA (0.57) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11763425 0.96 LMNA (0.57) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11764559 0.90 ALDH1A1 (0.53) LMNAALDH1A1CYP3A4TDP1
SCHEMBL11764563 0.90 ALDH1A1 (0.53) LMNAALDH1A1CYP3A4TDP1
SCHEMBL11767511 0.89 ALDH1A1 (0.56) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11767507 0.89 ALDH1A1 (0.56) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11760650 0.87 LMNA (0.69) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11760652 0.87 LMNA (0.69) LMNAALDH1A1CYP3A4TDP1PTPN1
SCHEMBL11766737 0.86 ALDH1A1 (0.51) LMNAALDH1A1CYP3A4TDP1PTPN1

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-4021461-A INSECTICIDES ZOECON CORPORATION (US) 1977-05-03 — — US disclosed
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