SCHEMBL2845905

SCHEMBL2845905

CCn1c([S+](C)[O-])nc(-c2ccc(F)cc2)c1-c1ccnc(NC2CCCCC2)c1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.60
MAPK10 P53779 2/20 0.49
EGFR P00533 1/20 0.45
RAF1 P04049 1/20 0.45
ERBB2 P04626 1/20 0.45
KDR P35968 1/20 0.45
MAPK8 P45983 1/20 0.45
MAPK9 P45984 1/20 0.45

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
SCHEMBL2849131 1.00 MAPK14 (0.60) MAPK14MAPK10EGFRRAF1ERBB2
SCHEMBL2845855 0.99 MAPK14 (0.58) MAPK14MAPK10
SCHEMBL2841223 0.90 MAPK14 (0.75) MAPK14MAPK10
SCHEMBL2842835 0.90 MAPK14 (0.75) MAPK14MAPK10
SCHEMBL2846010 0.90 MAPK14 (0.59) MAPK14MAPK10
SCHEMBL2843804 0.90 MAPK14 (0.59) MAPK14MAPK10
SCHEMBL2840659 0.89 MAPK14 (0.73) MAPK14MAPK10
SCHEMBL2846681 0.89 MAPK14 (0.57) MAPK14MAPK10
SCHEMBL2849199 0.88 MAPK14 (0.68) MAPK14MAPK10
SCHEMBL2845912 0.88 MAPK14 (0.68) MAPK14MAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273833-A1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS MERCKLE GMBH (DE) 2010-10-28 US claimed
EP-1853581-B1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS MERCKLE GMBH (DE) 2010-06-02 EP claimed
US-20100273833-A1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS MERCKLE GMBH (DE) 2010-10-28 US disclosed
US-20100273833-A1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS MERCKLE GMBH (DE) 2010-10-28 US disclosed
EP-1853581-B1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS MERCKLE GMBH (DE) 2010-06-02 EP 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-20100273833-A1 2-SULFINYL- AND 2-SULFONYL-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS IL2, IL2RA, IL1B MAPK14 1604/4885MAPK10 1817/4885EGFR 2025/4885

“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.