SCHEMBL9107541

SCHEMBL9107541

CC(C)(C)OC(=O)NC(Cc1ccc(-c2ccccn2)cc1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.53
CTSK P43235 4/20 0.53
REN P00797 3/20 0.51
CTSB P07858 2/20 0.48
CTSL P07711 1/20 0.48
BCL2 P10415 1/20 0.48
SCN9A Q15858 2/20 0.47
ACE P12821 1/20 0.47
PTPN1 P18031 2/20 0.46
HDAC8 Q9BY41 1/20 0.46
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44
ITGB1 P05556 1/20 0.44
ITGAV P06756 1/20 0.44
ITGB5 P18084 1/20 0.44
PTPRB P23467 1/20 0.44
CYP3A4 P08684 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
SCHEMBL5028161 1.00 CTSS (0.53) CTSSCTSKRENCTSBCTSL
SCHEMBL3728427 0.90 ACE (0.58) CTSSCTSKCTSBCTSLBCL2
SCHEMBL2307394 0.90 ACE (0.58) CTSSCTSKCTSBCTSLBCL2
SCHEMBL31407374 0.90 ACE (0.58) CTSSCTSKCTSBCTSLBCL2
SCHEMBL2307387 0.90 ACE (0.58) CTSSCTSKCTSBCTSLBCL2
SCHEMBL6163430 0.89 CTSS (0.53) CTSSCTSKCTSBCTSLBCL2
SCHEMBL27354055 0.89 CTSS (0.53) CTSSCTSKCTSBCTSLBCL2
SCHEMBL24438783 0.86 CTSS (0.69) CTSSCTSKRENCTSBCTSL
SCHEMBL8182259 0.86 CTSS (0.69) CTSSCTSKRENCTSBCTSL
SCHEMBL13821431 0.86 CTSS (0.69) CTSSCTSKRENCTSBCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902688-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2018-02-27 US disclosed
EP-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 EP disclosed
EP-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 EP disclosed
US-20160318852-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS ALEXION PHARMACEUTICALS, INC. 2016-11-03 US disclosed
US-9359375-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 US disclosed
US-20150038492-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-8846928-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2014-09-30 US disclosed
US-20120142671-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120142671-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK CTSS 1406/4885CTSK 1202/4885REN 4517/4885
US-20160318852-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK CTSS 1406/4885CTSK 1202/4885REN 4517/4885
US-20150038492-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS SYK, BTK, NADK CTSS 1406/4885CTSK 1202/4885REN 4517/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.