SCHEMBL1542882

SCHEMBL1542882

Cc1ccccc1-c1ccc(C(=O)NC2CCCC2C(=O)NO)cn1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 9/20 0.56
▸ CYP2C9 P11712 1/20 0.44
▸ MAPK14 Q16539 1/20 0.44
▸ MMP3 P08254 1/20 0.41
▸ MMP7 P09237 1/20 0.41
▸ MMP10 P09238 1/20 0.41

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
SCHEMBL5898284 1.00 ADAM17 (0.56) ADAM17CYP2C9MAPK14MMP3MMP7
SCHEMBL1542799 0.87 ADAM17 (0.51) ADAM17
SCHEMBL5898055 0.87 ADAM17 (0.51) ADAM17
SCHEMBL6836251 0.84 ADAM17 (0.57) ADAM17MMP3MMP7MMP10
SCHEMBL5898241 0.84 ADAM17 (0.57) ADAM17MMP3MMP7MMP10
SCHEMBL5898479 0.76 ADAM17 (0.54) ADAM17
SCHEMBL5897966 0.74 ADAM17 (0.55) ADAM17MAPK14MMP7
SCHEMBL5897928 0.74 ADAM17 (0.58) ADAM17MMP7
SCHEMBL5898398 0.73 ADAM17 (0.51) ADAM17MAPK14
SCHEMBL7416002 0.72 HDAC1 (0.54) ADAM17

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
JP-2011524893-A — — 2011-09-08 — — JP claimed
EP-2307377-A1 NICOTINAMIDE DERIVATIVES Pfizer Limited (GB) 2011-04-13 — — EP claimed
US-20100173888-A1 Nicotinamide Derivatives PFIZER INC 2010-07-08 — — US claimed
WO-2009153720-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 — — WO claimed
EP-2307377-A1 NICOTINAMIDE DERIVATIVES Pfizer Limited (GB) 2011-04-13 — — EP disclosed
US-20100173888-A1 Nicotinamide Derivatives PFIZER INC 2010-07-08 — — US disclosed
WO-2009153720-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 — — 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-20100173888-A1 Nicotinamide Derivatives NNT, NAMPT, NQO1 ADAM17 2409/4885CYP2C9 405/4885MAPK14 2795/4885

“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.

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