SCHEMBL3770936

SCHEMBL3770936

CC(C)c1ccc(OC(c2ccccc2)c2ccc(C(Oc3ccc(C(C)C)cc3)c3ccccc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.51
F2 P00734 2/20 0.49
PRSS1 P07477 1/20 0.44
IDO1 P14902 2/20 0.42
TDO2 P48775 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
ALOX5 P09917 1/20 0.41
SCN1A P35498 2/20 0.40
SCN2A Q99250 2/20 0.40
SCN3A Q9NY46 2/20 0.40
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
FFAR1 O14842 1/20 0.39
SLC6A4 P31645 1/20 0.39
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL27871819 1.00 SRD5A2 (0.51) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL27871817 0.96 SRD5A2 (0.47) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL3770932 0.94 SRD5A2 (0.44) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL3758781 0.93 SRD5A2 (0.46) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL3758778 0.89 SRD5A2 (0.42) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL14268020 0.83 ALOX5 (0.55) ADRA2AADRA2BADRA2CALOX5SCN3A
SCHEMBL824952 0.83 SRD5A2 (0.55) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL824943 0.83 SRD5A2 (0.55) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL9859672 0.82 SRD5A2 (0.57) SRD5A2F2PRSS1IDO1TDO2
SCHEMBL11998996 0.81 SLC7A5 (0.58) SRD5A2F2PRSS1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8978553-B2 Heat-sensitive lithographic printing plates MITSUBISHI PAPER MILLS LIMITED (JP) 2015-03-17 US disclosed
US-20120192740-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING PLATE AND LITHOGRAPHIC PRINTING METHOD MITSUBISHI PAPER MILLS LIMITED (JP) 2012-08-02 US disclosed
US-20100307359-A1 HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATES MITSUBISHI PAPER MILLS LIMITED (JP) 2010-12-09 US disclosed