SCHEMBL7201643

SCHEMBL7201643

O=C(NO)C1(O)CNCCC1S(=O)(=O)N1CCC(Oc2ccncc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 6/20 0.41
NAMPT P43490 7/20 0.40
MMP1 P03956 3/20 0.40
EPHX2 P34913 2/20 0.38
MMP2 P08253 4/20 0.38
MMP14 P50281 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2J2 P51589 1/20 0.36
ADAM17 P78536 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL7199648 0.90 HTR2C (0.44) MMP13EPHX2MMP2ADAM17
SCHEMBL7208848 0.89 CHRNB2 (0.44) MMP13NAMPTMMP1EPHX2MMP2
SCHEMBL7204519 0.88 MMP13 (0.43) MMP13MMP1EPHX2MMP2ADAM17
SCHEMBL7202573 0.88 MMP13 (0.43) MMP13NAMPTMMP1EPHX2MMP2
SCHEMBL7200991 0.88 MMP13 (0.43) MMP13MMP1EPHX2MMP2ADAM17
SCHEMBL7201546 0.88 SMN1; SMN2 (0.48) MMP13MMP1EPHX2MMP2MMP14
SCHEMBL7207005 0.85 MMP13 (0.42) MMP13NAMPTMMP1MMP2MMP14
SCHEMBL7205659 0.85 TP53 (0.41) MMP13NAMPTMMP1MMP2ADAM17
SCHEMBL7202351 0.84 ADAM17 (0.45) MMP13ADAM17
SCHEMBL7200602 0.83 EPHX2 (0.41) MMP13MMP1EPHX2MMP2ADAM17

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-6608104-B2 Antiarthritic agents; anticancer agents PFIZER INC 2003-08-19 US disclosed
US-20020019534-A1 Gem substituted hydroxamic acids PFIZER INC. 2002-02-14 US disclosed
EP-1138680-A1 Gem substituted sulfonyl hydroxamic acids as MMP inhibitors Pfizer Products Inc. (US) 2001-10-04 EP 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-20020019534-A1 Gem substituted hydroxamic acids MMP14, TOP2A, ADAMTS1 MMP13 4/4885NAMPT 4299/4885MMP1 8/4885

“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.