SCHEMBL7341009

SCHEMBL7341009

N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F12 P00748 12/20 0.50
▸ PRSS1 P07477 8/20 0.50
▸ F2 P00734 8/20 0.50
▸ PLG P00747 7/20 0.50
▸ F10 P00742 3/20 0.50
▸ KLK1 P06870 3/20 0.50
▸ C1R P00736 2/20 0.50
▸ TMPRSS2 O15393 1/20 0.50
▸ MLNR O43193 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ ITGB3 P05106 1/20 0.50
▸ HPN P05981 1/20 0.50
▸ CHRM2 P08172 1/20 0.50
▸ ITGA2B P08514 1/20 0.50
▸ C1S P09871 1/20 0.50
▸ ADORA3 P0DMS8 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ DRD2 P14416 1/20 0.50

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
Nafamostat SCHEMBL29429445 0.84 PRSS1 (0.64) F12PRSS1F2PLGF10
Nafamostat SCHEMBL29429443 0.84 PRSS1 (0.64) F12PRSS1F2PLGF10
Nafamostat SCHEMBL16069975 0.84 PRSS1 (0.64) F12PRSS1F2PLGF10
Nafamostat SCHEMBL135503 0.84 PRSS1 (0.64) F12PRSS1F2PLGF10
SCHEMBL7342063 0.83 F12 (0.54) F12PRSS1F2PLGF10
Nafamostat SCHEMBL3302794 0.83 PRSS1 (0.63) F12PRSS1F2PLGF10
Nafamostat SCHEMBL7345508 0.82 PRSS1 (0.62) F12PRSS1F2PLGF10
SCHEMBL20008652 0.81 F12 (0.46) F12PRSS1F2PLGF10
SCHEMBL7341911 0.80 PRSS1 (0.56) F12PRSS1F2PLGF10
Nafamostat SCHEMBL7051240 0.79 PLAU (0.58) F12PRSS1F2PLGF10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048433-B1 NOVEL AMIDINE COMPOUNDS, PROCESS FOR PRODUCING SAME AND ANTI-COMPLEMENT AGENT COMPRISING THEM TORII & CO., LTD. (JP) 1986-05-28 — — EP disclosed
US-4532255-A Amidine compounds and anticomplement agent comprising same TORII & CO., LTD. (JP) 1985-07-30 — — US disclosed
US-4454338-A 6-AMIDINO-2-NATHTHYL-4-GUANIDINOBENZOATE TORII & CO., LTD. (JP) 1984-06-12 — — US disclosed
EP-0048433-A2 Novel amidine compounds, process for producing same and anti-complement agent comprising them TORII & CO., LTD. (JP) 1982-03-31 — — EP disclosed
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