SCHEMBL3973469

SCHEMBL3973469

CS(=O)(=O)c1ccc(Cl)c(-c2n[nH]c3nc(Oc4ccc(F)cc4F)nc(OCC(O)CO)c23)c1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.40
MAPK11 Q15759 1/20 0.40
BRD4 O60885 9/20 0.38
ALDH1A1 P00352 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 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
SCHEMBL13763715 1.00 MAPK14 (0.40) MAPK14MAPK11BRD4ALDH1A1PTGS1
SCHEMBL13763716 1.00 MAPK14 (0.40) MAPK14MAPK11BRD4ALDH1A1PTGS1
SCHEMBL3971775 0.87 MAPK14 (0.41) MAPK14MAPK11BRD4PTGS1PTGS2
SCHEMBL13763718 0.87 MAPK14 (0.41) MAPK14MAPK11BRD4PTGS1PTGS2
SCHEMBL4016140 0.86 MAPK14 (0.38) MAPK14MAPK11
SCHEMBL4016129 0.86 MAPK14 (0.38) MAPK14MAPK11
SCHEMBL3968994 0.84 MAPK14 (0.43) MAPK14MAPK11BRD4PTGS1PTGS2
SCHEMBL4844719 0.84 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL14019063 0.84 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL13763717 0.84 MAPK14 (0.43) MAPK14MAPK11BRD4PTGS1PTGS2

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-7563799-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 map kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-07-21 US claimed
US-7563799-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 map kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-07-21 US disclosed
US-20070049598-A1 p38 Map kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 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 (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-20070049598-A1 p38 Map kinase inhibitors and methods for using the same MAPK1, MAPK3, MAP3K1 MAPK14 36/4885MAPK11 31/4885BRD4 2451/4885

“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.