SCHEMBL16246245

SCHEMBL16246245

CC(C)(C)OC(=O)Nc1ccc(CCOS(C)(=O)=O)nc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPKAPK2 P49137 10/20 0.44
▸ NAMPT P43490 1/20 0.42
▸ CYP17A1 P05093 2/20 0.41
▸ SREBF2 Q12772 1/20 0.38
▸ PSMB8 P28062 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37

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
SCHEMBL1894319 0.88 NAMPT (0.44) MAPKAPK2NAMPTCYP17A1PSMB8RORC
SCHEMBL26640219 0.83 NAMPT (0.45) MAPKAPK2NAMPTCYP17A1PSMB8RORC
SCHEMBL16245958 0.82 NAMPT (0.47) MAPKAPK2NAMPTCYP17A1SREBF2PSMB8
SCHEMBL16246318 0.82 MAPKAPK2 (0.40) MAPKAPK2NAMPT
SCHEMBL27167710 0.81 CYP17A1 (0.51) NAMPTCYP17A1PSMB8
SCHEMBL16246250 0.81 NAMPT (0.46) MAPKAPK2NAMPTCYP17A1SREBF2PSMB8
SCHEMBL29850092 0.79 NAMPT (0.49) MAPKAPK2NAMPTCYP17A1SREBF2PSMB8
SCHEMBL853159 0.79 NAMPT (0.49) MAPKAPK2NAMPTCYP17A1SREBF2PSMB8
SCHEMBL17247383 0.79 MAPKAPK2 (0.53) MAPKAPK2NAMPTCYP17A1SREBF2PSMB8
SCHEMBL14260617 0.78 NAMPT (0.48) MAPKAPK2NAMPTCYP17A1PSMB8MAP4K4

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
EP-2994470-B1 PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS FIBROBLAST GROWTH FACTOR INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2018-04-18 — — EP disclosed
US-9630963-B2 Quinolone derivatives as fibroblast growth factor inhibitors PRINCIPIA BIOPHARMA, INC. (US) 2017-04-25 — — US disclosed
US-20160130268-A1 QUINOLONE DERIVATIVES AS FIBROBLAST GROWTH FACTOR INHIBITORS PRINCIPIA BIOPHARMA INC. 2016-05-12 — — US disclosed
EP-2994470-A1 QUINOLONE DERIVATIVES AS FIBROBLAST GROWTH FACTOR INHIBITORS Principia Biopharma Inc. (US) 2016-03-16 — — EP disclosed
WO-2014182829-A1 QUINOLONE DERIVATIVES AS FIBROBLAST GROWTH FACTOR INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-11-13 — — 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-20160130268-A1 QUINOLONE DERIVATIVES AS FIBROBLAST GROWTH FACTOR INHIBITORS FGFR1, FGFR3, FGFR2 MAPKAPK2 1497/4885NAMPT 833/4885CYP17A1 1380/4885

“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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