SCHEMBL7034232

SCHEMBL7034232

CCOC(=O)N[C@@H](CNC(=O)c1ccc(OCCNC(=O)NCc2ccncc2)cc1O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 6/20 0.40
ITGA2B P08514 2/20 0.40
NAMPT P43490 5/20 0.40
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ITGAV P06756 4/20 0.39
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
PPID Q08752 1/20 0.37
EGLN2 Q96KS0 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
NPC1 O15118 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL7036608 0.94 ITGB3 (0.43) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7033860 0.94 ITGB3 (0.48) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7035255 0.93 ITGB3 (0.46) ITGB3ITGA2BNAMPTITGAVKMT2A
SCHEMBL7038294 0.93 NAMPT (0.41) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7393007 0.92 ITGB3 (0.47) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7032833 0.92 ITGB3 (0.39) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7254990 0.92 NAMPT (0.43) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7030930 0.92 ITGB3 (0.46) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7032247 0.92 ITGB3 (0.46) ITGB3ITGA2BNAMPTLMNASMN1; SMN2
SCHEMBL7035656 0.91 NAMPT (0.38) ITGB3ITGA2BNAMPTLMNASMN1; SMN2

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-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2003-10-02 US claimed
US-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 2003-10-02 US disclosed
WO-1999052879-A1 ACYLRESORCINOL DERIVATIVES AS SELECTIVE VITRONECTIN RECEPTOR INHIBITORS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-21 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-20030186967-A1 Acylresorcinol derivatives are selective vitronectin receptor inhibitors ASGR1, TEK, APLNR ITGB3 403/4885ITGA2B 573/4885NAMPT 566/4885

“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.