SCHEMBL3002997

SCHEMBL3002997

CC(C)(C)OC(=O)CC1CCC(NC(=O)C(Cc2ccccc2)NC(=O)OCc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.55
CTSK P43235 4/20 0.55
CTSB P07858 6/20 0.51
CTSS P25774 2/20 0.51
TACR1 P25103 2/20 0.49
SCN9A Q15858 2/20 0.49

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
SCHEMBL3002994 1.00 CTSL (0.55) CTSLCTSKCTSBCTSSTACR1
SCHEMBL31333314 0.86 ALDH1A1 (0.60) CTSLCTSKCTSB
SCHEMBL21144825 0.82 CTSL (0.55) CTSLCTSKCTSBCTSSTACR1
SCHEMBL18930779 0.82 CTSL (0.55) CTSLCTSKCTSBCTSSTACR1
SCHEMBL18920632 0.82 CTSL (0.55) CTSLCTSKCTSBCTSSTACR1
SCHEMBL10706018 0.81 CTSL (0.64) CTSLCTSKCTSBCTSSTACR1
SCHEMBL7274495 0.80 CTSS (0.60) CTSLCTSKCTSBCTSSSCN9A
SCHEMBL6329537 0.79 CTSK (0.57) CTSLCTSKCTSBCTSSTACR1
SCHEMBL31333474 0.78 SYK (0.47)
SCHEMBL31334655 0.78 SYK (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2152664-B1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2014-09-03 EP disclosed
US-8367709-B2 Dipeptide analogs as coagulation factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-02-05 US disclosed
US-20100173899-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-07-08 US disclosed
EP-2152664-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS Brystol-Myers Squibb Company (US) 2010-02-17 EP disclosed
WO-2008157162-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-24 WO 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-20100173899-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS F11, TFPI, SERPINC1 CTSL 230/4885CTSK 280/4885CTSB 590/4885

“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.