SCHEMBL8913898

SCHEMBL8913898

NC(=O)c1ccccc1-c1ccccc1.O=C(O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc2cnccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.47
P2RX7 Q99572 7/20 0.45
FLT3 P36888 2/20 0.45
MELK Q14680 2/20 0.44
MAPK1 P28482 1/20 0.44
CAMKK2 Q96RR4 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PRKD3 O94806 1/20 0.44
TP53 P04637 1/20 0.44
PRKCG P05129 1/20 0.44
PRKCB P05771 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
PRKCA P17252 1/20 0.44
PRKACA P17612 1/20 0.44
NFKB1 P19838 1/20 0.44
PRKACG P22612 1/20 0.44
PRKACB P22694 1/20 0.44
PRKCH P24723 1/20 0.44

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
SCHEMBL8913335 0.86 KCNA5 (0.47) KCNA5P2RX7FLT3MELKMAPK1
SCHEMBL8912797 0.85 SLC1A3 (0.47) KCNA5FLT3MELKMAPK1CAMKK2
SCHEMBL8913470 0.81 HTT (0.50) KCNA5MAPK1CYP3A4MMP2MMP9
SCHEMBL8914454 0.80 P2RX7 (0.51) P2RX7MELKMEN1KMT2APRKD3
SCHEMBL8912407 0.78 MMP2 (0.67) MEN1KMT2AMMP2MMP9ADAMTS4
SCHEMBL27146771 0.77 MMP2 (0.59) MEN1KMT2AMMP2MMP9ADAMTS4
SCHEMBL27146770 0.77 MMP2 (0.59) MEN1KMT2AMMP2MMP9ADAMTS4
SCHEMBL6522675 0.74 MMP2 (0.66) MMP2MMP9ADAMTS4
SCHEMBL8914953 0.74 MMP2 (0.63) TP53MMP2MMP9ADAMTS4
SCHEMBL7428005 0.73 MELK (0.48) KCNA5P2RX7FLT3MELKMAPK1

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-5663174-A ANTIINFLAMMATORY AGENTS, INHIBITOR OF KINASES, ANTIARTHRITIC AGENTS PHARNO-WEDROPHARM GMBH (DE) 1997-09-02 US disclosed
EP-0602028-B1 AROMATIC SULFONAMIDE DERIVATIVES, THEIR USE AS ENZYME INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARNO WEDROPHARM GMBH (DE) 1996-01-17 EP disclosed