SCHEMBL29586356

SCHEMBL29586356

C=C(C)CCOC1CCC(=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
BTN3A1 O00481 1/20 0.33

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
SCHEMBL8009649 0.81
SCHEMBL9398167 0.79 EPHX1 (0.46) EPHX1BTN3A1
SCHEMBL9398020 0.77 EPHX1 (0.49) EPHX1BTN3A1
SCHEMBL5010017 0.75 PIK3CA (0.33)
SCHEMBL600619 0.75 CHRM2 (0.32)
SCHEMBL31034510 0.73 DDB1 (0.33)
SCHEMBL3010206 0.73 KMT2A (0.34)
SCHEMBL1207182 0.72
SCHEMBL1574372 0.72 CRBN (0.36)
SCHEMBL4749367 0.70 EPHX2 (0.40)

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-109563016-B Method for producing perfluoroalkyl compound using monohydroperfluoroalkane as starting material 关东电化工业株式会社 2022-05-13 CN disclosed