SCHEMBL8113283

SCHEMBL8113283

CC(C)c1ccc(NC(=O)CN(Cc2cn(CC(=O)O)cn2)c2cccc(C(=N)N)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.46
PRSS1 P07477 5/20 0.46
F2 P00734 3/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
LMNA P02545 1/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
ITGB3 P05106 3/20 0.36
ITGA2B P08514 3/20 0.36
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPC1 O15118 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35

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
Hydrochloric Acid SCHEMBL8104637 0.94 F10 (0.43) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8118540 0.92 F10 (0.43) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8115063 0.91 F10 (0.43) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8114113 0.88 F10 (0.44) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8118836 0.87 F10 (0.42) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8105346 0.87 F10 (0.42) F10PRSS1F2PRSS2PRSS3
SCHEMBL8118867 0.78 PRSS1 (0.48) F10PRSS1F2PRSS2PRSS3
SCHEMBL8113287 0.77 F10 (0.51) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8119899 0.77 F10 (0.44) F10PRSS1F2PRSS2PRSS3
Hydrochloric Acid SCHEMBL8104721 0.77 F10 (0.69) F10PRSS1F2PRSS2PRSS3

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-1020434-A1 3-AMIDINOANILINE DERIVATIVES, ACTIVATED BLOOD COAGULATION FACTOR X INHIBITORS, AND INTERMEDIATES FOR PRODUCING BOTH Kissei Pharmaceutical Co., Ltd. (JP) 2000-07-19 EP disclosed