SCHEMBL9568486

SCHEMBL9568486

C=CC(=O)Nc1ccccc1S(=O)(=O)NC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.44
MAPK3 P27361 2/20 0.42
RORC P51449 2/20 0.41
PTPN1 P18031 1/20 0.40
PTPN11 Q06124 1/20 0.40
NSD2 O96028 2/20 0.40
USP30 Q70CQ3 7/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 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
SCHEMBL3813620 0.86 TGM2 (0.47) TGM2RORCPTPN1PTPN11CA1
SCHEMBL9568826 0.81 TGM2 (0.42) TGM2RORCPTPN1PTPN11USP30
SCHEMBL9568730 0.81 RORC (0.45) TGM2RORCPTPN1PTPN11ALDH1A1
SCHEMBL3821676 0.80 POLB (0.53) RORCALDH1A1
SCHEMBL9568581 0.80 CA12 (0.56) RORCALDH1A1CYP3A4CYP2C19CA1
SCHEMBL29588334 0.80 TGM2 (0.50) TGM2RORCPTPN1PTPN11CA1
SCHEMBL1813156 0.80 TGM2 (0.50) TGM2RORCPTPN1PTPN11CA1
SCHEMBL393747 0.79 NPC1 (0.41) RORCNSD2USP30CA1CA2
SCHEMBL3820006 0.79 TGM2 (0.56) TGM2ALDH1A1CYP3A4CYP2C19
SCHEMBL964767 0.78 CA1 (0.59) TGM2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0544264-A1 Light-sensitive composition FUJI PHOTO FILM CO., LTD. (JP) 1993-06-02 EP disclosed