SCHEMBL14079878

SCHEMBL14079878

C=C(F)/C(=C\C=C/C)c1ccc(C(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.37
▸ CYP2C9 P11712 2/20 0.33
▸ USP5 P45974 1/20 0.33
▸ TYR P14679 2/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL25679459 0.81 ALDH1A1 (0.34) HTTCYP2C9MEN1ALDH1A1LMNA
SCHEMBL20904157 0.75 HTT (0.38) HTTCYP2C9USP5TYRMEN1
SCHEMBL717192 0.64 HTT (0.52) HTTCYP2C9USP5TYRMEN1
SCHEMBL8242358 0.64 HTT (0.52) HTTCYP2C9USP5TYRMEN1
SCHEMBL14132737 0.63 HTT (0.61) HTTCYP2C9USP5TYRMEN1
SCHEMBL28928453 0.63 HTT (0.50) HTTCYP2C9USP5TYRMEN1
SCHEMBL27539251 0.63 HTT (0.50) HTTCYP2C9USP5TYRMEN1
SCHEMBL19409851 0.63 HTT (0.50) HTTCYP2C9USP5TYRMEN1
SCHEMBL2098167 0.63 HTT (0.50) HTTCYP2C9USP5TYRMEN1
SCHEMBL28305276 0.63 HTT (0.50) HTTCYP2C9USP5TYRMEN1

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
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 — — EP disclosed
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