SCHEMBL5634071

SCHEMBL5634071

COc1cccc(C(=O)c2cnc(Nc3cccc(C(F)(F)F)c3)s2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 3/20 0.76
MAPK12 P53778 3/20 0.76
MAPK11 Q15759 3/20 0.76
MAPK14 Q16539 3/20 0.76
SCD O00767 1/20 0.54
MAPT P10636 3/20 0.53
KDM4E B2RXH2 1/20 0.53
MDM2 Q00987 1/20 0.53
HKDC1 Q2TB90 1/20 0.53
SAE1 Q9UBE0 1/20 0.53
UBA2 Q9UBT2 1/20 0.53
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RXFP1 Q9HBX9 1/20 0.49
CCNA2 P20248 1/20 0.49
CDK2 P24941 1/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C2 P52895 1/20 0.49

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
SCHEMBL5635378 0.86 MAPK13 (0.70) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5633973 0.85 MAPK13 (0.57) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5634358 0.85 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5634621 0.85 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5633679 0.84 MAPK13 (0.87) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5634706 0.83 RAB9A (0.57) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5635397 0.83 MAPK13 (0.77) MAPK13MAPK12MAPK11MAPK14CCNA2
SCHEMBL5634557 0.82 MAPK13 (0.57) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5634447 0.82 NPC1 (0.71) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL5634379 0.82 MAPK13 (0.53) MAPK13MAPK12MAPK11MAPK14MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-20040038990-A1 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. 2004-02-26 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-20040038990-A1 Aminothiazole derivatives FABP4, GPR119, ABAT MAPK13 3018/4885MAPK12 2608/4885MAPK11 2347/4885

“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.