SCHEMBL6791068

SCHEMBL6791068

O=C(CNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NC(CNC(=O)C1CCN(c2ccncc2)CC1)C(=O)N1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.44
ITGB3 P05106 7/20 0.44
ITGA2B P08514 7/20 0.44
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BDKRB1 P46663 1/20 0.39
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.37
LSS P48449 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
SCHEMBL6793666 0.89 F10 (0.55) F10ITGB3ITGA2B
SCHEMBL6792769 0.84 F10 (0.54) F10
SCHEMBL6788822 0.82 F10 (0.54) F10ITGB3ITGA2BUSP2HPGD
SCHEMBL6794296 0.81 F10 (0.54) F10ITGB3ITGA2B
SCHEMBL6794601 0.81 F10 (0.55) F10ITGB3ITGA2B
SCHEMBL6798932 0.81 F10 (0.57) F10
SCHEMBL6789748 0.81 F10 (0.56) F10ITGB3ITGA2B
SCHEMBL6794603 0.81 F10 (0.55) F10ITGB3ITGA2B
SCHEMBL8548825 0.80 ITGB3 (0.48) F10ITGB3ITGA2BSMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL6786102 0.80 ITGB3 (0.47) F10ITGB3ITGA2BSMN1; SMN2KMT2A

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
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-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

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 F10 35/4885ITGB3 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.