SCHEMBL7747754

SCHEMBL7747754

CCCCCCCCCCCCCCCCCCNC(=O)C(=O)NC(=O)CCP(=O)(OCC)OCC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
NAAA Q02083 1/20 0.42
PLA2G2A P14555 1/20 0.41
LPAR3 Q9UBY5 2/20 0.41
EPHX1 P07099 5/20 0.41
LPAR1 Q92633 2/20 0.40
ENPP2 Q13822 1/20 0.40
LPAR2 Q9HBW0 1/20 0.40
S1PR2 O95136 2/20 0.39
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 2/20 0.39
S1PR5 Q9H228 1/20 0.39
FAAH O00519 1/20 0.39
EPHX2 P34913 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
SCHEMBL7750830 0.91 CASP2 (0.43) CASP2NAAAPLA2G2ALPAR3EPHX1
SCHEMBL8589706 0.91 CASP2 (0.43) CASP2NAAAPLA2G2ALPAR3EPHX1
SCHEMBL7743599 0.88 EPHX1 (0.49) CASP2CA12CA1CA2CA9
SCHEMBL7747761 0.87 CASP2 (0.59) CASP2CA12CA1CA2CA9
SCHEMBL7747982 0.86 CASP2 (0.47) CASP2CA12CA1CA2CA9
SCHEMBL7749125 0.83 HSP90AA1 (0.46) LPAR3LPAR1ENPP2LPAR2FAAH
SCHEMBL13853974 0.80 CASP2 (0.57) CASP2CA12CA1CA2CA9
SCHEMBL18248592 0.79 CASP2 (0.56) CASP2NAAALPAR3LPAR1ENPP2
SCHEMBL7747903 0.79 FAAH (0.51) CASP2LPAR3LPAR1ENPP2LPAR2
SCHEMBL7743817 0.78 LPAR1 (0.47) CASP2LPAR3EPHX1LPAR1ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed
US-5817599-A COLORLESS DYE PRECURSOR AND REVERSIBLE COLOR DEVELOPER MITSUBISHI PAPER MILLS LIMITED (JP) 1998-10-06 US disclosed