SCHEMBL11870740

SCHEMBL11870740

CCOC(=O)C=C(C)C=CCCC(C)CCCC(C)(C)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ MAPT P10636 3/20 0.38
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ALOX15 P16050 2/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ HCAR2 Q8TDS4 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
SCHEMBL11870736 1.00 ALDH1A1 (0.46) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11764157 0.91 ALDH1A1 (0.46) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11764162 0.91 ALDH1A1 (0.46) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11867829 0.89 ALDH1A1 (0.45) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11867834 0.89 ALDH1A1 (0.45) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11863322 0.89 ALDH1A1 (0.58) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11863325 0.89 ALDH1A1 (0.58) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11864860 0.88 ALDH1A1 (0.49) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11864855 0.88 ALDH1A1 (0.49) ALDH1A1CYP3A4LMNATDP1MAPT
SCHEMBL11865737 0.87 CYP3A4 (0.50) ALDH1A1CYP3A4LMNATDP1MEN1

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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