SCHEMBL6162515

SCHEMBL6162515

Nc1c(C(=O)c2cccc(Br)c2)cnn1-c1ccc(F)cc1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.73
GAK O14976 1/20 0.61
LCK P06239 1/20 0.61
CYP3A4 P08684 1/20 0.61
PDGFRB P09619 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C9 P11712 1/20 0.61
MAPK9 P45984 1/20 0.61
MAPK10 P53779 1/20 0.61
EPHA5 P54756 1/20 0.61
MAPK11 Q15759 1/20 0.61

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
SCHEMBL1386400 0.88 MAPK14 (0.77) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL2354967 0.87 MAPK14 (0.75) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL6159398 0.86 MAPK14 (0.73) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL6158122 0.86 MAPK14 (0.73) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL6161922 0.85 MAPK14 (0.71) MAPK14
SCHEMBL6160339 0.85 MAPK14 (0.69) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL2358527 0.83 MAPK14 (0.70) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL6159367 0.83 MAPK14 (0.70) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL6159246 0.83 MAPK14 (0.69) MAPK14GAKLCKCYP3A4PDGFRB
SCHEMBL4731609 0.82 MAPK14 (0.77) MAPK14GAKLCKCYP3A4PDGFRB

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6979693-B2 Pyrazole derivatives-p38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC (US) 2005-12-27 US disclosed
EP-1075467-B1 PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2005-03-30 EP disclosed
CN-1147476-C Pyrazole derivatives as P-38 MAP kinase inhibitors - 2004-04-28 CN disclosed
US-20030018051-A1 Pyrazole derivatives - p38 MAP kinase inhibitors GOLDSTEIN DAVID MICHAEL (US) 2003-01-23 US disclosed
US-20020156114-A1 Pyrazole derivatives - p38 MAP kinase inhibitors GOLDSTEIN DAVID MICHAEL (US) 2002-10-24 US disclosed
CN-1376147-A Pyrazole derivatives HOFFMANN LA ROCHE (CH) 2002-10-23 CN disclosed
US-6444696-B1 1-ARYL OR HETEROARYL SUBSTITUTED 5-AMINO-4 CARBONYLPYRAZOLE DERIVATIVES; ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) LLC 2002-09-03 US disclosed
US-20020103245-A1 Pyrazole derivatives P38 MAP kinase inhibitors GOLDSTEIN DAVID MICHAEL (US) 2002-08-01 US disclosed
US-6376527-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES SYNTEX (U.S.A.) LLC 2002-04-23 US disclosed
US-6316466-B1 Pyrazole derivatives P-38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC 2001-11-13 US disclosed
CN-1300282-A Pyrazole derivatives as P-38 MAP kinase inhibitors HOFFMANN LA ROCHE (CH) 2001-06-20 CN 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 (3 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-20030018051-A1 Pyrazole derivatives - p38 MAP kinase inhibitors MAPK1, MAPK8, MAP3K8 MAPK14 32/4885GAK 164/4885LCK 422/4885
US-20020103245-A1 Pyrazole derivatives P38 MAP kinase inhibitors MAPK1, MAPK8, MAPKAPK2 MAPK14 34/4885GAK 169/4885LCK 358/4885
US-20020156114-A1 Pyrazole derivatives - p38 MAP kinase inhibitors MAPK1, MAPK8, MAP3K8 MAPK14 32/4885GAK 164/4885LCK 422/4885

“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.