SCHEMBL7419660

SCHEMBL7419660

N=C(N)c1cccc(CN2C[CH]C2=O)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 3/20 0.51
PRSS2 P07478 3/20 0.51
PRSS3 P35030 3/20 0.51
LOXL2 Q9Y4K0 1/20 0.51
PLG P00747 2/20 0.48
PLAU P00749 1/20 0.48
F10 P00742 16/20 0.47
HPN P05981 1/20 0.47
ST14 Q9Y5Y6 1/20 0.47
PROC P04070 1/20 0.45
F2 P00734 1/20 0.44

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
SCHEMBL2897345 0.86 PRSS1 (0.49) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL27478261 0.84 F10 (0.48) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL27495114 0.80 PRSS1 (0.51) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL27479044 0.78 L3MBTL1 (0.51) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL6049827 0.78 F10 (0.48) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL7413859 0.77 F10 (0.56) PLGF10PROCF2
SCHEMBL24322923 0.76 F10 (0.57) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL24322934 0.76 F10 (0.58) PLGF10PROCF2
SCHEMBL8000015 0.76 F10 (0.53) PRSS1PRSS2PRSS3LOXL2PLG
SCHEMBL24323873 0.76 F10 (0.58) PLGF10PROCF2

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