SCHEMBL28142104

SCHEMBL28142104

CC1=CCCO1.Cc1ccco1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.58

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
SCHEMBL257414 0.78
Oxirane SCHEMBL826683 0.77
SCHEMBL1331033 0.76
SCHEMBL28732539 0.76 TP53 (1.00) TP53
SCHEMBL37253 0.76
SCHEMBL28134150 0.74 CA1 (0.35)
Methane SCHEMBL25269682 0.73
Benzene SCHEMBL28530954 0.73 TP53 (0.94) TP53
Ethane SCHEMBL3670045 0.73
Water SCHEMBL14353431 0.73

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
CN-106554263-A A kind of preparation method of cyclopropyl methyl ketone 江苏清泉化学股份有限公司 2017-04-05 CN disclosed