SCHEMBL4475438

SCHEMBL4475438

CS(=O)(=O)CCNc1nc(Oc2ccc(F)cc2F)nc2c1c(-c1ccccc1Cl)nn2COC(=O)CCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 7/20 0.41
FABP3 P05413 2/20 0.35
FABP7 O15540 1/20 0.34
FABP5 Q01469 1/20 0.34
MAPK8 P45983 3/20 0.33
CTSA P10619 2/20 0.32
BRD4 O60885 2/20 0.32
TOP2A P11388 1/20 0.32
DGAT2 Q96PD7 2/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
MAPK11 Q15759 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL13672546 0.91 MAPK14 (0.43) MAPK14MAPK8BRD4MAPK9MAPK10
SCHEMBL4475490 0.89 MAPK14 (0.38) MAPK14FABP3FABP7FABP5CTSA
SCHEMBL4485397 0.88 MAPK14 (0.40) MAPK14MAPK8BRD4DGAT2MAPK9
SCHEMBL4484559 0.88 MAPK14 (0.46) MAPK14MAPK8BRD4DGAT2MAPK9
SCHEMBL4479724 0.88 FABP3 (0.37) FABP3FABP7FABP5CTSADGAT2
SCHEMBL4480138 0.88 FABP3 (0.37) FABP3FABP7FABP5CTSADGAT2
SCHEMBL4475774 0.87 MAPK14 (0.42) MAPK14MAPK8BRD4DGAT2MAPK9
SCHEMBL4755290 0.85 FABP3 (0.36) MAPK14FABP3FABP7FABP5CTSA
SCHEMBL4475285 0.79 MAPK14 (0.42) MAPK14MAPK8BRD4MAPK9MAPK10
SCHEMBL13672578 0.79 MAPK14 (0.42) MAPK14MAPK8BRD4MAPK9MAPK10

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-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US claimed
US-7608603-B2 Substituted pyrazolo[3,4-D]pyrimidines as p38 MAP kinase inhibitors ROCHE PALO ALTO LLC (US) 2009-10-27 US disclosed
US-20070049597-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-20070049597-A1 p38 MAP kinase inhibitors and methods for using the same MAPK1, MAPK9, MAPK3 MAPK14 22/4885FABP3 3757/4885FABP7 3804/4885

“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.