SCHEMBL3885292

SCHEMBL3885292

Cc1ccccc1Oc1c(-c2ccnc(Oc3ccccc3)n2)n2n(c1=O)CCC2

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.41
MAPK13 O15264 9/20 0.39
MAPK12 P53778 9/20 0.39
MAPK11 Q15759 9/20 0.39
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 3/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 2/20 0.38
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
USP2 O75604 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3877389 0.83 MAPK13 (0.38) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL3880327 0.82 MAPK13 (0.38) MAPK14MAPK13MAPK12MAPK11MEN1
SCHEMBL5622448 0.80 MAPK13 (0.38) MAPK14MAPK13MAPK12MAPK11
SCHEMBL3884933 0.79 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL3884925 0.79 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11MAPK1
SCHEMBL5622451 0.79 MAPK13 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL3881036 0.78 MAPK14 (0.42) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL3889121 0.78 MAPK13 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5622943 0.78 MAPK13 (0.41) MAPK14MAPK13MAPK12MAPK11
SCHEMBL8273809 0.77 MAPK13 (0.44) MAPK14MAPK13MAPK12MAPK11

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-7482356-B2 Bicyclic pyrazolone cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2009-01-27 US claimed
US-20050113392-A1 Bicyclic pyrazolone cytokine inhibitors THE PROCTER & GAMBLE COMPANY (US) 2005-05-26 US claimed
US-20090069355-A1 Bicyclic pyrazolone cytokine inhibitors CLARK MICHAEL PHILIP 2009-03-12 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 (2 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-20050113392-A1 Bicyclic pyrazolone cytokine inhibitors IL1B, IL1A, IL1RN MAPK14 922/4885MAPK13 2033/4885MAPK12 2453/4885
US-20090069355-A1 Bicyclic pyrazolone cytokine inhibitors IL1B, IL1A, IL1RN MAPK14 922/4885MAPK13 2033/4885MAPK12 2453/4885

“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.