SCHEMBL7379899

SCHEMBL7379899

NC(=O)N1CC[C@](Cc2cc3c(N)nccc3cc2N)(OC(=O)C(F)(F)F)C1=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 16/20 0.33
KLK1 P06870 8/20 0.33
F10 P00742 1/20 0.32
F2 P00734 1/20 0.31
F11 P03951 1/20 0.31
ROCK1 Q13464 1/20 0.30

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
SCHEMBL7382750 0.81
SCHEMBL7383565 0.80 EIF2AK3 (0.36) ROCK1
SCHEMBL7374815 0.78 SLC22A12 (0.31)
SCHEMBL7368812 0.78 NR4A2 (0.31)
SCHEMBL7378094 0.76 MAP4K4 (0.34)
SCHEMBL7377308 0.76 HSP90AB1 (0.35) F10
SCHEMBL7379895 0.76 HSP90AB1 (0.35) F10
SCHEMBL7375448 0.76 NCF1 (0.32)
SCHEMBL7379461 0.75
SCHEMBL7379420 0.74 P2RY12 (0.34)

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-0944386-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2001-04-11 EP claimed
EP-0944386-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-09-29 EP claimed
WO-1998025611-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-06-18 WO claimed