SCHEMBL27600786

SCHEMBL27600786

Cc1cc(C(C)(C)C)c(O)c(C)c1CN=C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 5/20 0.46
LMNA P02545 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 3/20 0.46
CYP1A2 P05177 3/20 0.46
TSHR P16473 3/20 0.46
CYP2D6 P10635 3/20 0.46
PTGS2 P35354 3/20 0.46
HTR1A P08908 2/20 0.46
ADRA2A P08913 2/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
ADRA1D P25100 1/20 0.46
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46

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
SCHEMBL4194073 0.80 ALDH1A1 (0.53) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL10814873 0.78 CYP2C19 (0.61) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL10980164 0.77 CYP2C19 (0.54) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL30913173 0.76 CYP2C19 (0.52) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL3672873 0.76 CYP2C19 (0.52) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL10000643 0.76 CYP2C19 (0.52) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL30913172 0.76 CYP2C19 (0.52) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL427584 0.75 PGK1 (0.42) CYP3A4HSD17B10HPGD
SCHEMBL9331710 0.75 CYP2C19 (0.58) CYP2C19LMNAMEN1KMT2ACYP3A4
SCHEMBL3176330 0.75 CYP2C19 (0.51) CYP2C19LMNAMEN1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102732100-B Transparent topcoat composition and its antihunt means 施乐公司 2019-09-06 CN disclosed
CN-108137929-B Resin composition, resin molded article, method for producing resin molded article with plating layer, and method for producing portable electronic device component having antenna 三菱工程塑料株式会社 2019-07-16 CN disclosed
CN-108137929-A Resin composition, resin molded article, method for producing resin molded article with plating layer, and method for producing portable electronic device component having antenna 三菱工程塑料株式会社 2018-06-08 CN disclosed
CN-100365083-C Hardening resin composition and protective film SUMITOMO CHEMICAL CO (JP) 2008-01-30 CN disclosed
CN-1490368-A Hardening resin composition and protective film 住友化学工业株式会社 2004-04-21 CN disclosed