SCHEMBL6180661

SCHEMBL6180661

O=C(O)C[C@@H](CCCC1CCCCC1)c1nc(C(=O)NS(=O)(=O)c2cccc3cccnc23)no1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 20/20 0.64
MMP2 P08253 4/20 0.64
MMP3 P08254 1/20 0.64
MMP9 P14780 1/20 0.64
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48

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
SCHEMBL6179734 0.92 BMP1 (0.74) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179914 0.85 BMP1 (0.85) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179285 0.81 BMP1 (0.85) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179738 0.81 BMP1 (0.85) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179010 0.80 BMP1 (0.67) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179443 0.80 BMP1 (0.72) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6180711 0.79 BMP1 (0.85) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6179694 0.79 BMP1 (0.64) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6178402 0.78 BMP1 (0.62) BMP1MMP2MMP3MMP9PDE4A
SCHEMBL6178395 0.78 BMP1 (1.00) BMP1MMP2MMP3MMP9PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373231-B1 3-HETEROCYCLYL-PROPANO-HYDROXAMIC ACID AS PCP INHIBITORS PFIZER LTD (GB) 2005-06-08 EP disclosed
US-6831088-B2 Wound healing agents; antiscarring agents PFIZER INC. 2004-12-14 US disclosed
US-20040058917-A1 3-Heterocyclylpropanohydroxamic acid PCP inhibitors FISH PAUL VINCENT (GB) 2004-03-25 US disclosed
EP-1373231-A1 3-HETEROCYCLYLPROPANOHYDROXAMIC ACID PCP INHIBITORS Pfizer Limited (GB) 2004-01-02 EP disclosed
US-6645993-B2 3-heterocyclylpropanohydroxamic acid PCP inhibitors WARNER-LAMBERT COMPANY 2003-11-11 US disclosed
US-20020187979-A1 3-heterocyclylpropanohydroxamic acid PCP inhibitors FISH PAUL VINCENT (GB) 2002-12-12 US disclosed
WO-2002079175-A1 3-HETEROCYCLYLPROPANOHYDROXAMIC ACID PCP INHIBITORS PFIZER LIMITED (GB) 2002-10-10 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 (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-20040058917-A1 3-Heterocyclylpropanohydroxamic acid PCP inhibitors PAH, FAP, PREP BMP1 77/4885MMP2 34/4885MMP3 38/4885
US-20020187979-A1 3-heterocyclylpropanohydroxamic acid PCP inhibitors MMP1, CPA1, PAH BMP1 26/4885MMP2 28/4885MMP3 32/4885

“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.