SCHEMBL5104532

SCHEMBL5104532

Cn1c(SCCCN2C(=O)c3ccccc3C2=O)nc(-c2ccc(F)cc2)c1-c1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.56
MAPK13 O15264 6/20 0.56
MAPK12 P53778 6/20 0.56
MAPK11 Q15759 6/20 0.56
TNKS2 Q9H2K2 1/20 0.46
GCGR P47871 2/20 0.45
MAPK10 P53779 2/20 0.45
CSNK1D P48730 2/20 0.44
ALOX5 P09917 1/20 0.44
POLB P06746 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL5097798 0.94 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5104332 0.81 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL14033804 0.81 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5097718 0.80 MAPK14 (0.65) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL21466389 0.79 FAAH (0.50) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5104620 0.79 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5097818 0.79 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL14033305 0.78 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL5104603 0.77 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11GCGR
SCHEMBL16573709 0.77 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11GCGR

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-7442713-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2008-10-28 US disclosed
US-7442713-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2008-10-28 US disclosed
US-7442713-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE GMBH (DE) 2008-10-28 US disclosed
US-20060252810-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics LAUFER STEFAN 2006-11-09 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-20060252810-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics IL2, TPMT, IFNG MAPK14 3913/4885MAPK13 3863/4885MAPK12 3593/4885

“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.