SCHEMBL10953236

SCHEMBL10953236

CCCCCCC1SC(=S)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.48
▸ CA2 P00918 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PSMD14 O00487 1/20 0.41
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ADAMTS5 Q9UNA0 1/20 0.37
▸ HLCS P50747 1/20 0.36
▸ DAGLA Q9Y4D2 1/20 0.34

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
SCHEMBL19542362 0.82 EPHX2 (0.64) EPHX2KDM4EMAPTADAMTS5DAGLA
SCHEMBL5845119 0.82 EPHX2 (0.64) EPHX2KDM4EMAPTADAMTS5DAGLA
SCHEMBL23641349 0.82 EPHX2 (0.64) EPHX2KDM4EMAPTADAMTS5DAGLA
SCHEMBL3075482 0.81 CA2 (0.56) CA2ALDH1A1MEN1HPGDKMT2A
SCHEMBL645409 0.80 EPHX2 (0.62) EPHX2CA2ALDH1A1MEN1HPGD
SCHEMBL8165382 0.71 CA2 (0.68) CA2KMT2A
Water SCHEMBL9798786 0.70 MAOB (0.46) EPHX2ALDH1A1MEN1HPGDKMT2A
SCHEMBL13749934 0.69 PSMD14 (0.53) CA2MEN1KMT2AKDM4EPSMD14
SCHEMBL8639587 0.68 HLCS (0.37) EPHX2ALDH1A1MEN1HPGDKMT2A
SCHEMBL9408903 0.67 ALDH1A1 (0.44) ALDH1A1MEN1HPGDKMT2AKDM4E

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-4547360-A APPLYING CYANO(3-PHENOXYPHENYL)METHYL-4-CHLORO-ALPHA-(1-METHYLETHYL)BENZENE ACETATE THE HARTZ MOUNTAIN CORPORATION (US) 1985-10-15 — — US disclosed
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