SCHEMBL7073602

SCHEMBL7073602

COC(=O)CC1Cc2ccc(/C=C/CCCCN)cc2NC1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
USP2 O75604 1/20 0.34
GAA P10253 1/20 0.34
CACNA1G O43497 2/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
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
SCHEMBL7073605 1.00 HTT (0.36) HTTHSD17B10USP2GAACACNA1G
SCHEMBL7075839 0.97 HTT (0.36) HTTHSD17B10USP2GAACACNA1G
SCHEMBL7075842 0.97 HTT (0.36) HTTHSD17B10USP2GAACACNA1G
SCHEMBL7071181 0.93 HSD17B10 (0.38) HTTHSD17B10USP2GAA
SCHEMBL7071178 0.93 HSD17B10 (0.38) HTTHSD17B10USP2GAA
SCHEMBL7077487 0.87 USP2 (0.32) HTTHSD17B10USP2GAA
SCHEMBL7072109 0.87 USP2 (0.32) HTTHSD17B10USP2GAA
Trifluoroacetic Acid SCHEMBL7075182 0.87 HTT (0.34) HTTHSD17B10USP2GAA
Trifluoroacetic Acid SCHEMBL7075185 0.87 HTT (0.34) HTTHSD17B10USP2GAA
SCHEMBL7073127 0.86 USP2 (0.34) HTTHSD17B10USP2GAA

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 HTT 4867/4885HSD17B10 3835/4885USP2 2558/4885

“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.