SCHEMBL7409384

SCHEMBL7409384

N=C(N)c1ccc2[nH]c(Cc3nc4cc(S(=O)(=O)NCc5ccccc5)ccc4[nH]3)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.53
F2 P00734 6/20 0.53
F7 P08709 2/20 0.53
CHEK2 O96017 1/20 0.51
TPSAB1 Q15661 3/20 0.49
PRSS1 P07477 2/20 0.49
PLG P00747 1/20 0.49
PLAU P00749 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
PKM P14618 1/20 0.48
TPSD1 Q9BZJ3 1/20 0.48
TPSG1 Q9NRR2 1/20 0.48
POLB P06746 1/20 0.44
KLK1 P06870 1/20 0.43
KLK5 Q9Y337 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43

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
SCHEMBL7503638 0.90 F2 (0.59) F10F2F7CHEK2TPSAB1
SCHEMBL7407083 0.90 IDO1 (0.50) F10F2F7TPSAB1PRSS1
SCHEMBL7403269 0.89 F2 (0.52) F10F2F7CHEK2TPSAB1
SCHEMBL7405344 0.88 F2 (0.55) F10F2F7CHEK2PKM
SCHEMBL7406306 0.87 F2 (0.51) F10F2F7CHEK2TPSAB1
SCHEMBL7405346 0.86 CHEK2 (0.49) F10F2CHEK2PRSS1PRSS2
SCHEMBL7405396 0.85 F2 (0.50) F10F2F7TPSAB1PRSS1
SCHEMBL7401825 0.81 F10 (0.49) F10F2F7TPSAB1PRSS1
SCHEMBL7411113 0.81 F10 (0.60) F10F2F7TPSAB1PRSS1
SCHEMBL7400229 0.81 F10 (0.60) F10F2F7TPSAB1PRSS1

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-1999026932-A1 BY AMIDINO GROUP SUBSTITUTED HETEROCYCLIC DERIVATIVES AND THEIR USE AS ANTICOAGULANTS AXYS PHARMACEUTICALS, INC. (US) 1999-06-03 WO disclosed