SCHEMBL6936522

SCHEMBL6936522

CCN(c1ccccc1O)c1nc(-c2ccncc2)c(-c2ccccc2F)c(=O)n1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.35
MAPK14 Q16539 4/20 0.34
CASR P41180 3/20 0.34
ALOX5 P09917 1/20 0.33
CDC7 O00311 1/20 0.33
DBF4 Q9UBU7 1/20 0.33
HSP90AA1 P07900 1/20 0.33
ADORA2A P29274 4/20 0.33
ADORA1 P30542 3/20 0.33
CSNK1D P48730 2/20 0.32
ADORA3 P0DMS8 2/20 0.32
ADORA2B P29275 2/20 0.32
BRAF P15056 1/20 0.32
CSNK1E P49674 1/20 0.32
KDM1A O60341 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAP4K1 Q92918 1/20 0.32
MAPK13 O15264 2/20 0.32
MAPK9 P45984 2/20 0.32

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
SCHEMBL6936441 0.88 MAPK14 (0.46) GSK3BMAPK14ALOX5ADORA2AADORA1
SCHEMBL6693653 0.74 MAPK14 (0.45) GSK3BMAPK14ADORA2AADORA1CSNK1D
SCHEMBL6936520 0.70 GSK3B (0.58) GSK3BMAPK14ADORA2AADORA1CSNK1D
SCHEMBL6937232 0.68 MAPK9 (0.44) GSK3BMAPK14CASRADORA2AADORA1
SCHEMBL7215940 0.67 MAPK14 (0.43) MAPK14ALOX5ADORA2AADORA1CSNK1D
SCHEMBL6929759 0.65 GSK3B (0.49) GSK3BMAPK14CASRADORA2AADORA1
SCHEMBL7233308 0.59 MAPK14 (0.46) GSK3BMAPK14ALOX5ADORA2AADORA1
SCHEMBL4816067 0.59 MAPK9 (0.56) MAPK14ALOX5CSNK1DBRAFKDM1A
SCHEMBL30418017 0.57 NPC1 (0.58) MAPK14CDC7ADORA2AADORA1CSNK1D
SCHEMBL2649506 0.57 NPC1 (0.58) MAPK14CDC7ADORA2AADORA1CSNK1D

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-6649604-B2 Analgesics; antidiabetic agents; antiinflamamtory agents AMGEN INC. 2003-11-18 US disclosed
US-20030073704-A1 Substituted pyridone compounds and methods of use AMGEN INC. 2003-04-17 US disclosed
US-6420385-B1 INFLAMMATORY, PAIN AND DIABETES DISEASES, AMGEN INC. 2002-07-16 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-20030073704-A1 Substituted pyridone compounds and methods of use IL6, IL1B, IL1A GSK3B 2369/4885MAPK14 1169/4885CASR 3373/4885

“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.