SCHEMBL7036653

SCHEMBL7036653

N=C(N)NCCOc1ccc(C(=O)NC[C@H](NC(=O)Nc2cccc3ccccc23)C(=O)O)c(O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.39
ALOX12 P18054 1/20 0.39
ANPEP P15144 1/20 0.39
F10 P00742 1/20 0.39
KDM4E B2RXH2 4/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ITGB3 P05106 2/20 0.38
ITGAV P06756 2/20 0.38
TRPV1 Q8NER1 2/20 0.37
GSK3B P49841 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HTT P42858 1/20 0.36
CASP3 P42574 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
SCHEMBL7038269 0.89 PYGL (0.41) MEN1KMT2AALDH1A1ANPEPF10
SCHEMBL7032586 0.89 PYGL (0.41) MEN1KMT2AALDH1A1ANPEPF10
SCHEMBL7030499 0.89 F10 (0.38) MEN1KMT2AALDH1A1MAPTF10
SCHEMBL7035239 0.89 F10 (0.38) MEN1KMT2AALDH1A1ANPEPF10
SCHEMBL7036018 0.88 F10 (0.42) MEN1KMT2AF10POLBITGB3
SCHEMBL7034753 0.88 ALDH1A1 (0.43) MEN1KMT2AALDH1A1ANPEPPOLB
SCHEMBL7036058 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTALOX12
SCHEMBL7039028 0.86 ITGB3 (0.41) MEN1KMT2AALDH1A1MAPTF10
SCHEMBL7039300 0.84 F10 (0.46) MEN1KMT2AF10POLBSMN1; SMN2
SCHEMBL7037813 0.84 ITGB3 (0.49) MEN1KMT2AF10POLBSMN1; 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 2 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

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 MEN1 1162/4885KMT2A 3514/4885ALDH1A1 2356/4885

“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.