SCHEMBL8380889

SCHEMBL8380889

C=C(C)C1C(=O)CCC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.30
CYP3A4 P08684 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
SCHEMBL11399520 0.69 HTT (0.36)
SCHEMBL2990437 0.69
SCHEMBL2264463 0.68 ALDH1A1 (0.40)
SCHEMBL7751334 0.66
SCHEMBL8813613 0.65 UGT2B7 (0.33)
SCHEMBL10260827 0.64 CYP3A4 (0.32) CYP3A4
SCHEMBL4135825 0.62 ALDH1A1 (0.40)
SCHEMBL22228955 0.61 CYP2C19 (0.42) CYP2C19CYP3A4
SCHEMBL22242559 0.61 CYP2C19 (0.42) CYP2C19CYP3A4
SCHEMBL12687625 0.61 CYP3A4 (0.39) CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11255698-A None JP disclosed
JP-H11255698-A PRODUCTION OF 2-ALKENYL-SUBSTITUTED CYCLOPENTENONES SUMITOMO CHEM CO LTD 1999-09-21 JP disclosed