SCHEMBL6955200

SCHEMBL6955200

N=C(N)c1ccc2ccc(CN(c3ccc(OC4CCNCC4)cc3)S(=O)(=O)CC(N)=O)cc2c1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.69
F2 P00734 5/20 0.69
KCNH2 Q12809 1/20 0.62
PRSS1 P07477 1/20 0.51

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 SCHEMBL6960169 0.93 F10 (0.77) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6951322 0.87 F10 (0.61) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6954901 0.86 F10 (0.90) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6956978 0.86 F10 (0.62) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6952216 0.86 F10 (0.61) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6959683 0.86 F10 (0.63) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6959467 0.86 F10 (0.63) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6956359 0.85 F10 (0.68) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6955750 0.85 F10 (0.60) F10F2KCNH2PRSS1
Hydrochloric Acid SCHEMBL6956045 0.85 F10 (0.60) F10F2KCNH2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0798295-B1 NOVEL AMIDINONAPHTHYL DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMA CO LTD (JP) 2003-02-26 EP disclosed
EP-0798295-A1 NOVEL AMIDINONAPHTHYL DERIVATIVE OR SALT THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-10-01 EP disclosed