SCHEMBL7999873

SCHEMBL7999873

COc1ccc2cc(S(=O)(=O)N3CCN(Cc4ccc(C(=N)N)cc4)C(=O)C3)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.61
F2 P00734 7/20 0.52
PLG P00747 2/20 0.51
PROC P04070 2/20 0.51
PRSS1 P07477 2/20 0.51
KDM4E B2RXH2 1/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PLAT P00750 1/20 0.48

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
SCHEMBL7999856 0.98 F10 (0.64) F10F2PLGPROCPRSS1
SCHEMBL8003260 0.93 F10 (0.58) F10F2PLGPROCPRSS1
SCHEMBL1652295 0.92 F10 (0.56) F10F2KDM4ETSHR
SCHEMBL1651311 0.90 F10 (0.65) F10F2PLGPROCPRSS1
SCHEMBL7986939 0.89 F10 (0.66) F10F2PLGPROCPRSS1
SCHEMBL8003156 0.89 F10 (0.61) F10F2PLGPROCPRSS1
SCHEMBL1303308 0.88 F10 (0.71) F10F2
Hydrochloric Acid SCHEMBL6896958 0.88 F10 (0.61) F10F2PLGPROCPRSS1
Hydrochloric Acid SCHEMBL6895022 0.87 F10 (0.70) F10F2
SCHEMBL7997641 0.86 F10 (0.58) F10F2PLGPROCPRSS1

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
WO-2000008005-A2 PIPERAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2000-02-17 WO disclosed