SCHEMBL8239095

SCHEMBL8239095

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nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 3/20 0.48
MMP2 P08253 2/20 0.48
ITGA4 P13612 3/20 0.47
ITGB1 P05556 5/20 0.46
ITGA5 P08648 2/20 0.46
ITGAV P06756 1/20 0.45
ITGA2 P17301 1/20 0.43
MMP1 P03956 1/20 0.42
MMP13 P45452 1/20 0.42
KMT2A Q03164 1/20 0.41
FKBP1A P62942 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL4256087 1.00 MMP9 (0.48) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL12084369 0.92 MMP9 (0.47) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL5499020 0.90 ITGA4 (0.56) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL4259952 0.86 ITGB1 (0.51) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL8248902 0.86 ITGB1 (0.51) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL8246157 0.82 MMP2 (0.56) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL18349175 0.82 ITGB1 (0.55) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL4253017 0.81 ITGB1 (0.56) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL8245244 0.81 ITGB1 (0.56) MMP9MMP2ITGA4ITGB1ITGA5
SCHEMBL8238744 0.81 MMP9 (0.47) MMP9MMP2ITGA4ITGB1ITGA2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258159-B2 Inhibitors of the α2β1/GPIa-IIa integrin THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-09-04 US disclosed
US-8258159-B2 Inhibitors of the α2β1/GPIa-IIa integrin THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2012-09-04 US disclosed
US-20090233968-A1 INHIBITORS OF THE ALPHA2BETA1/GPIa-IIA INTEGRIN THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-09-17 US disclosed
US-20090233968-A1 INHIBITORS OF THE ALPHA2BETA1/GPIa-IIA INTEGRIN THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-09-17 US disclosed
WO-2006133338-A1 INHIBITORS OF THE α2β1/GPIa-IIa INTEGRIN THE TRUSTEES OF THE UNIVERSITY OF PENNESYLVANIA (US) 2006-12-14 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-20090233968-A1 INHIBITORS OF THE ALPHA2BETA1/GPIa-IIA INTEGRIN ITGA2B, ITGB2, ITGA2 MMP9 800/4885MMP2 695/4885ITGA4 17/4885

“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.