SCHEMBL5774623

SCHEMBL5774623

Cc1onc(-c2ccc(F)cc2F)c1-c1ccc2nnc(-c3ccccc3)n2c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.50
HSP90AB1 P08238 1/20 0.43
PTGS1 P23219 3/20 0.40
PTGS2 P35354 3/20 0.40
KDM4E B2RXH2 1/20 0.40
NT5E P21589 1/20 0.40

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
SCHEMBL5796479 0.87 MAPK14 (0.61) MAPK14PTGS1PTGS2KDM4E
SCHEMBL5774840 0.84 MAPK14 (0.66) MAPK14
SCHEMBL5773881 0.82 MAPK14 (0.47) MAPK14KDM4E
SCHEMBL4767834 0.79 MAPK14 (0.76) MAPK14
SCHEMBL5774150 0.79 MAPK14 (0.47) MAPK14KDM4E
SCHEMBL5771340 0.77 MAPK14 (0.49) MAPK14KDM4E
SCHEMBL5776605 0.72 CCNC (0.47) MAPK14
SCHEMBL4828259 0.71 MAPK14 (0.76) MAPK14
SCHEMBL1930478 0.70 L3MBTL1 (0.63) HSP90AB1PTGS1PTGS2KDM4E
SCHEMBL6068995 0.70 MAPK14 (0.76) MAPK14

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
EP-1370559-B1 TRIAZOLOPYRIDINES AS ANTI-INFLAMMATORY AGENTS PFIZER PROD INC (US) 2006-04-19 EP disclosed
US-6696464-B2 POTENT INHIBITORS OF MAP KINASES, PREFERABLY P38 KINASE; USEFUL IN TREATMENT OF INFLAMMATION, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS, CANCER, REPERFUSION OR ISCHEMIA IN STROKE OR HEART ATTACK PFIZER INC 2004-02-24 US disclosed
US-20030096838-A1 Novel triazolo-pyridines anti-inflammatory compounds PFIZER INC. 2003-05-22 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-20030096838-A1 Novel triazolo-pyridines anti-inflammatory compounds MAPK1, CNKSR1, JAK1 MAPK14 15/4885HSP90AB1 340/4885PTGS1 6/4885

“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.