SCHEMBL8113287

SCHEMBL8113287

CC(C)c1ccc(NC(=O)CN(Cc2cccc(Cl)c2)c2cccc(C(=N)N)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.51
F2 P00734 2/20 0.51
PRSS1 P07477 2/20 0.51
PRSS2 P07478 2/20 0.51
PRSS3 P35030 2/20 0.51
F7 P08709 3/20 0.46
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.41
RAB9A P51151 2/20 0.40
THRB P10828 1/20 0.40
KDM4E B2RXH2 1/20 0.40
RORC P51449 1/20 0.40
AKT1 P31749 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL8118867 0.92 PRSS1 (0.48) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8112435 0.89 F10 (0.48) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8118698 0.87 F2 (0.48) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8113077 0.87 F2 (0.48) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8119731 0.85 F10 (0.62) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8119899 0.85 F10 (0.44) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8104721 0.85 F10 (0.69) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8104157 0.85 PRSS1 (0.57) F10F2PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL8118722 0.84 F10 (0.60) F10F2PRSS1PRSS2PRSS3
SCHEMBL8115002 0.82 POLB (0.45) LMNAMAPTRAB9ATHRBRORC

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