SCHEMBL10052528

SCHEMBL10052528

CCOP(=O)(c1ccc(OC)cc1)N1Cc2ccsc2CC1C(=O)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 20/20 1.00
MMP1 P03956 11/20 1.00
MMP3 P08254 11/20 1.00
ADAM17 P78536 9/20 1.00
ADAM9 Q13443 9/20 1.00
AREG P15514 1/20 0.75

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
SCHEMBL10021367 1.00 MMP9 (1.00) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL10052673 0.77 MMP9 (1.00) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL10021368 0.77 MMP9 (1.00) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL8381087 0.74 MMP3 (0.68) MMP9MMP1MMP3
SCHEMBL10021369 0.70 MMP9 (0.78) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL8379816 0.66 MMP3 (0.68) MMP9MMP1MMP3
SCHEMBL8384868 0.64 SMN1; SMN2 (0.53) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL8383954 0.64 MMP8 (0.57) MMP9MMP1MMP3
SCHEMBL11558987 0.63 MMP9 (0.45) MMP9MMP1MMP3ADAM17ADAM9
SCHEMBL11562455 0.62 MMP9 (0.45) MMP9MMP1MMP3ADAM17ADAM9

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-20120174240-A1 ROLE OF PROTEOGLYCANS IN DRUG DEPENDENCE SANNA PIETRO P (US) 2012-07-05 US disclosed
US-8119854-B2 Role of proteoglycans in drug dependence Sanna, Pietro P. (US) 2012-02-21 US disclosed
US-20100199361-A1 Role of Proteoglycans in Drug Dependence Sanna, Pietro Paolo (US) 2010-08-05 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 (2 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-20120174240-A1 ROLE OF PROTEOGLYCANS IN DRUG DEPENDENCE OGFR, CSGALNACT1, OPRL1 MMP9 631/4885MMP1 1050/4885MMP3 233/4885
US-20100199361-A1 Role of Proteoglycans in Drug Dependence OGFR, CSGALNACT1, OPRL1 MMP9 631/4885MMP1 1050/4885MMP3 233/4885

“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.