SCHEMBL6793017

SCHEMBL6793017

CC(C)(C)OC(=O)NCC(NC(=O)OCc1ccccc1)C(=O)N1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.61
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
CTSL P07711 5/20 0.54
P2RX7 Q99572 8/20 0.51
CTSK P43235 7/20 0.49
CTSS P25774 3/20 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
SCHEMBL14497033 0.91 SYK (0.60) SYKITGB3ITGA2BP2RX7CTSK
SCHEMBL8235945 0.90 SYK (0.59) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL1143806 0.89 SYK (0.60) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL1143803 0.89 SYK (0.60) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL6766563 0.87 ITGB3 (0.65) SYKITGB3ITGA2B
SCHEMBL13598866 0.87 ITGB3 (0.65) SYKITGB3ITGA2B
SCHEMBL22975046 0.87 SYK (0.58) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL22975045 0.87 SYK (0.58) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL26010144 0.87 CTSL (0.52) SYKITGB3ITGA2BCTSLP2RX7
SCHEMBL9512398 0.85 P2RX7 (0.52) SYKITGB3ITGA2BCTSLP2RX7

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-6730672-B2 PROTEASE INHIBITOR ZENECA LIMITED (GB) 2004-05-04 US disclosed
US-20020119968-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED 2002-08-29 US disclosed
US-6225309-B1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LIMITED (GB) 2001-05-01 US disclosed
US-5965559-A STRONG INHIBITORY EFFECT AGAINST THE ACTIVATED COAGULATION PROTEASE KNOWN AS FACTOR XA; PREVENTION OF THE CLEAVAGE OF PROTHROMBIN TO THROMBIN; AMINO-SUBSTITUTED PYRIMIDINES AMIDINE GROUP-FREE ZENECA LIMITED (GB) 1999-10-12 US disclosed
EP-0783500-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LTD (GB) 1998-07-22 EP disclosed
CN-1164232-A Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents ZENECA LTD (GB) 1997-11-05 CN disclosed
EP-0783500-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1997-07-16 EP disclosed
WO-1996010022-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1996-04-04 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-20020119968-A1 Aminoheterocyclic derivatives as antithrombotic or anticoagulant agents SERPINC1, F2, SULT1E1 SYK 3693/4885ITGB3 254/4885ITGA2B 708/4885

“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.