SCHEMBL7427192

SCHEMBL7427192

N=C(N)c1cccc(CN2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.56
PLG P00747 1/20 0.55
PROC P04070 1/20 0.55
F2 P00734 6/20 0.53

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
Trifluoroacetic Acid SCHEMBL7423064 0.94 F10 (0.53) F10PLGPROCF2
SCHEMBL7421559 0.93 F10 (0.56) F10PLGPROCF2
Trifluoroacetic Acid SCHEMBL7418999 0.87 F10 (0.53) F10PLGPROCF2
SCHEMBL7425743 0.86 F10 (0.56) F10PLGPROCF2
SCHEMBL7420601 0.84 KCNH2 (0.48)
Trifluoroacetic Acid SCHEMBL7422491 0.82 F10 (0.55) F10PLGPROCF2
Trifluoroacetic Acid SCHEMBL7427883 0.81 F10 (0.53) F10PLGPROCF2
Trifluoroacetic Acid SCHEMBL7426456 0.79 F10 (0.55) F10PLGPROCF2
SCHEMBL24322949 0.78 F10 (0.67) F10PLGPROCF2
SCHEMBL24324315 0.78 F10 (0.67) F10PLGPROCF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP disclosed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 EP disclosed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed