SCHEMBL13376802

SCHEMBL13376802

CCn1cc(-c2ccnc(SC)n2)n(-c2ccc(F)cc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CSNK1E P49674 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
MAPK14 Q16539 7/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
CSNK1D P48730 3/20 0.37
JAK3 P52333 1/20 0.37
MET P08581 5/20 0.37
AXL P30530 5/20 0.37

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
SCHEMBL750140 0.81 MAPT (0.35) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL13376804 0.77 CCNA2 (0.42) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL751267 0.77 ALDH1A1 (0.46) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL13376809 0.77 ALDH1A1 (0.43) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL13376803 0.76 CCNA2 (0.41) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL12714295 0.70 KDM4E (0.45) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL13376582 0.70 MET (0.36) MAPK14MAPK13MAPK12MAPK11MET
SCHEMBL23795643 0.69 MAPK14 (0.66) CCNA2CDK2CSNK1ECDK5CDK5R1
SCHEMBL29841955 0.69 MAPK14 (0.66) CCNA2CDK2CSNK1ECDK5CDK5R1
SCHEMBL21621304 0.68 L3MBTL1 (0.58) ALDH1A1LMNAGAAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700771-B2 Heterocyclic compound which may be used as a medicine having p38 MAP kinase inhibitory activity MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-04-20 US disclosed
US-7700771-B2 Heterocyclic compound which may be used as a medicine having p38 MAP kinase inhibitory activity MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-04-20 US disclosed
US-20070185326-A1 antiinflammatory agents; antiarthritic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-08-09 US disclosed
US-20070185326-A1 antiinflammatory agents; antiarthritic agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-08-09 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-20070185326-A1 antiinflammatory agents; antiarthritic agents MAPK1, CHUK, MAPK3 ALDH1A1 2522/4885LMNA 4585/4885GAA 4746/4885

“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.