SCHEMBL7076624

SCHEMBL7076624

CCN(N=C(N)N)C(=O)c1ccc2c(c1)NC(=O)C(CC(=O)OC)C2

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 2/20 0.33
HTT P42858 1/20 0.33
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
ALOX15 P16050 1/20 0.32
SMYD3 Q9H7B4 1/20 0.30

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
Hydrochloric Acid SCHEMBL7071246 0.89 ITGB3 (0.40) ITGB3ITGA2B
SCHEMBL7076811 0.85 USP2 (0.36) USP2GAAHSD17B10HTTITGB3
SCHEMBL7071657 0.81 ITGB3 (0.33) USP2GAAHSD17B10HTTITGB3
SCHEMBL7073183 0.80 ITGB3 (0.33) USP2GAAHSD17B10HTTITGB3
SCHEMBL7078712 0.79 POLB (0.42) USP2GAAHSD17B10HTTALOX15
SCHEMBL7076818 0.76 ALOX15 (0.43) USP2GAAHSD17B10HTTALOX15
SCHEMBL7076807 0.75 TERT (0.44) GAAHSD17B10HTTSMYD3
SCHEMBL7076629 0.75 GAA (0.41) GAAITGB3ITGA2BSMYD3
SCHEMBL7073390 0.75 GAA (0.42) USP2GAAHSD17B10HTTALOX15
SCHEMBL7072903 0.74 USP2 (0.41) USP2GAAHSD17B10HTT

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
US-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin WYETH (US) 2003-06-12 US disclosed
US-6429214-B1 INHIBITORS OF BONE RESORPTION WYETH 2002-08-06 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-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin ITGAV, ITGB2, ITGB3 USP2 2558/4885GAA 2157/4885HSD17B10 3835/4885

“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.