SCHEMBL6774561

SCHEMBL6774561

CSc1ccc(-n2nnc(-c3ccc(F)cc3)c2-c2ccncc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.63
MAPK13 O15264 11/20 0.63
MAPK12 P53778 11/20 0.63
MAPK11 Q15759 11/20 0.63
GCGR P47871 7/20 0.58
PRKD3 O94806 1/20 0.50
MAP4K4 O95819 1/20 0.50
LCK P06239 1/20 0.50
RET P07949 1/20 0.50
ALOX5 P09917 1/20 0.50
PRKACA P17612 1/20 0.50
RPS6KB1 P23443 1/20 0.50
MATK P42679 1/20 0.50
FRK P42685 1/20 0.50
MAPK9 P45984 1/20 0.50
CSNK1A1 P48729 1/20 0.50
CSNK1D P48730 1/20 0.50
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50
CSNK1G2 P78368 1/20 0.50

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
SCHEMBL6772178 0.89 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11SRC
SCHEMBL6768792 0.86 SRC (0.60) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6779368 0.83 SRC (0.60) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6772362 0.83 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6623278 0.83 SRC (0.58) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6771371 0.82 SRC (0.62) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL6773296 0.82 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL6772267 0.81 PTGS2 (0.56) MAPK14MAPK13MAPK12MAPK11ALOX5
SCHEMBL6774270 0.81 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11CSNK1D
SCHEMBL6778842 0.80 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11SRC

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-6727364-B2 ANTIINFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY 2004-04-27 US claimed
US-20030013712-A1 Triazole compounds useful in treating diseases associated with unwanted cytokine activity PROCTER & GAMBLE COMPANY, THE 2003-01-16 US claimed
US-6727364-B2 ANTIINFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY 2004-04-27 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-20030013712-A1 Triazole compounds useful in treating diseases associated with unwanted cytokine activity IL4, IL1A, IL2 MAPK14 3429/4885MAPK13 4097/4885MAPK12 4447/4885

“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.