SCHEMBL10344282

SCHEMBL10344282

CCOC(=O)c1ccc(OC(=O)c2ccc(C(=O)Oc3ccc(C(=O)OCC)cc3)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.69
ACR P10323 1/20 0.69
CA12 O43570 2/20 0.66
CA1 P00915 2/20 0.66
CA2 P00918 2/20 0.66
CA7 P43166 2/20 0.66
CA9 Q16790 2/20 0.66
CA14 Q9ULX7 2/20 0.66
ESR1 P03372 1/20 0.66
ESR2 Q92731 1/20 0.66
CYP1A2 P05177 2/20 0.63
LMNA P02545 1/20 0.63
CYP3A4 P08684 1/20 0.63
MAOA P21397 1/20 0.63
STS P08842 1/20 0.62
HPGD P15428 4/20 0.56
HTT P42858 2/20 0.56
KMT2A Q03164 4/20 0.55
RARA P10276 1/20 0.54
RARB P10826 1/20 0.54

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
SCHEMBL8205439 0.94 PRSS1 (0.64) PRSS1ACRCA12CA1CA2
SCHEMBL6938102 0.93 ESR1 (0.79) PRSS1ACRCA12CA1CA2
SCHEMBL8206092 0.93 PRSS1 (0.62) PRSS1ACRCA12CA1CA2
SCHEMBL8205737 0.93 PRSS1 (0.62) PRSS1ACRCA12CA1CA2
SCHEMBL8207704 0.91 PRSS1 (0.61) PRSS1ACRCA12CA1CA2
SCHEMBL9856830 0.91 PRSS1 (0.61) PRSS1ACRCA12CA1CA2
SCHEMBL5793276 0.91 MAPT (0.62) PRSS1ACRCA12CA1CA2
SCHEMBL1721471 0.90 CA1 (0.63) PRSS1ACRCA12CA1CA2
SCHEMBL10344352 0.90 PRSS1 (0.59) PRSS1ACRCA12CA1CA2
SCHEMBL1176935 0.89 CA12 (0.61) PRSS1ACRCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170269487-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, METHOD FOR MANUFACTURING SAME AND ELECTROPHOTOGRAPHIC DEVICE FUJI ELECTRIC CO., LTD. (JP) 2017-09-21 US disclosed
US-20170269487-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, METHOD FOR MANUFACTURING SAME AND ELECTROPHOTOGRAPHIC DEVICE FUJI ELECTRIC CO., LTD. (JP) 2017-09-21 US disclosed
EP-0181404-B1 PHTHALATE COMPOUNDS Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-02-07 EP disclosed
EP-0181404-A1 PHTHALATE COMPOUNDS Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-05-21 EP disclosed