SCHEMBL5498150

SCHEMBL5498150

CCCCCCCCCCCCNC(C)CS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.44
CA1 P00915 2/20 0.44
PPARA Q07869 2/20 0.42
EPHX1 P07099 9/20 0.42
TP53 P04637 1/20 0.41
GRIA1 P42261 3/20 0.41
EPHX2 P34913 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
CA12 O43570 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38

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
SCHEMBL9656661 1.00 CA2 (0.44) CA2CA1PPARAEPHX1TP53
SCHEMBL7159366 0.98 CA2 (0.43) CA2CA1PPARAEPHX1TP53
SCHEMBL27882188 0.91 TP53 (0.38) CA2CA1PPARAEPHX1TP53
SCHEMBL11238313 0.82 CA2 (0.46) CA2CA1PPARAEPHX1TP53
SCHEMBL21623897 0.81 S1PR2 (0.43) CA2CA1PPARAEPHX1TP53
SCHEMBL21518401 0.81 S1PR2 (0.43) CA2CA1PPARAEPHX1TP53
SCHEMBL21623884 0.81 S1PR2 (0.43) CA2CA1PPARAEPHX1TP53
SCHEMBL21518434 0.81 S1PR2 (0.43) CA2CA1PPARAEPHX1TP53
SCHEMBL4407844 0.81 PPARA (0.40) CA2CA1PPARAEPHX1TP53
SCHEMBL21504437 0.81 APP (0.40) CA2CA1GRIA1CA12CA7

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
EP-1678289-B1 BAR SOAP COMPOSITION WITH REDUCED BAR WEAR PROPERTIES COLGATE PALMOLIVE CO (US) 2007-04-11 EP claimed
EP-0276872-B1 ELECTRODEPOSITION COATING COMPOSITION CONTAINING A MODIFIED EPOXY RESIN HAVING CHARGEABLE GROUPS Nippon Paint Co., Ltd. (JP) 1992-12-30 EP disclosed
US-4829105-A GRAFT POLYMERS, ANIONIC, HYDROPHILIC NIPPON PAINT CO., LTD. (JP) 1989-05-09 US disclosed
EP-0276872-A2 Electrodeposition coating composition containing a modified epoxy resin having chargeable groups Nippon Paint Co., Ltd. (JP) 1988-08-03 EP disclosed