SCHEMBL10074995

SCHEMBL10074995

CC(C)(CN)CNC(=O)CC(Cc1cc(F)ccc1F)NC(=O)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.42
CTRB1 P17538 2/20 0.41
KCNA5 P22460 1/20 0.38
CTSL P07711 2/20 0.38
CTSB P07858 2/20 0.38
CTSS P25774 2/20 0.38
OPRK1 P41145 1/20 0.37
CASP3 P42574 1/20 0.37
CTSK P43235 1/20 0.37
TACR1 P25103 1/20 0.37

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
SCHEMBL10074722 0.86 SYK (0.37) SYKCTRB1KCNA5CTSLCTSB
SCHEMBL10078259 0.86 SYK (0.37) SYKCTRB1KCNA5CTSLCTSB
SCHEMBL10074471 0.86 SYK (0.37) SYKCTRB1KCNA5CTSLCTSB
SCHEMBL10078060 0.85 DPP4 (0.36)
SCHEMBL6875812 0.85 SCN9A (0.39) CTSSCTSK
SCHEMBL10074997 0.85 PSMB1 (0.38) SYKCTRB1CTSLCTSBCTSS
SCHEMBL10074153 0.85 PSMB1 (0.38) SYKCTRB1CTSLCTSBCTSS
SCHEMBL10054519 0.82 CTRB1 (0.51) CTRB1KCNA5OPRK1CASP3
SCHEMBL10074727 0.82 SYK (0.42) SYKCTSSCTSK
SCHEMBL10078394 0.82 SYK (0.42) SYKCTSSCTSK

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-2418196-A1 Dual alanyl-aminopeptidase and dipeptidyl-peptidase IV inhibitors IMTM GmbH (DE) 2012-02-15 EP disclosed
US-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS IMTM GMBH (DE) 2012-02-02 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 (1 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-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS SERPINB1, CMA1, CPA3 SYK 2686/4885CTRB1 228/4885KCNA5 4850/4885

“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.