SCHEMBL1150867

SCHEMBL1150867

Fc1ccc(-c2[nH]c(=S)[nH]c2-c2ccncc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.68
GCGR P47871 7/20 0.56
MAPK13 O15264 5/20 0.56
MAPK12 P53778 5/20 0.56
MAPK11 Q15759 5/20 0.56
MAPK9 P45984 2/20 0.56
PRKD3 O94806 1/20 0.56
MAP4K4 O95819 1/20 0.56
FRK P42685 1/20 0.56
CSNK1A1 P48729 1/20 0.56
CSNK1D P48730 1/20 0.56
GSK3B P49841 1/20 0.56
PTK6 Q13882 1/20 0.56
PRKD2 Q9BZL6 1/20 0.56
CLK4 Q9HAZ1 1/20 0.56
BRAF P15056 1/20 0.54
RAF1 P04049 1/20 0.53
ALOX5 P09917 1/20 0.50

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
SCHEMBL11180564 0.88 ALDH1A1 (0.50) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL6937157 0.84 MAPK14 (0.64) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL828544 0.81 MAPK14 (0.55) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL4462710 0.81 MAPK14 (0.50) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL4461255 0.81 GCGR (0.58) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL4470689 0.80 NOTUM (0.56) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL4472359 0.79 MAPK14 (0.55) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL4096702 0.79 MAPK14 (0.44) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL14033245 0.77 MAPK14 (0.54) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL5091913 0.77 MAPK14 (0.54) MAPK14GCGRMAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170313661-A1 KINASE MODULATORS FOR THE TREATMENT OF CANCER SYNOVO GMBH (DE) 2017-11-02 US disclosed
US-9617221-B2 Kinase modulators for the treatment of cancer SYNOVO GMBH (DE) 2017-04-11 US disclosed
US-8461120-B2 Macrocyclic compounds pounds and methods of use thereof SYNOVO GMBH (DE) 2013-06-11 US disclosed
US-20130045938-A1 KINASE MODULATORS FOR THE TREATMENT OF CANCER SYNOVO GMBH (DE) 2013-02-21 US disclosed
US-20110028417-A1 Macrocyclic Compounds and Methods of Use Thereof SYNOVO GMBH (DE) 2011-02-03 US disclosed
US-7767797-B1 Macrocyclic compounds and methods of use thereof SYNOVO GMBH (DE) 2010-08-03 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE-GMBH (DE) 2006-10-19 US disclosed
EP-1539741-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE GMBH (DE) 2005-06-15 EP disclosed
WO-2004018458-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE-GMBH (DE) 2004-03-04 WO disclosed
US-6432988-B1 RHEUMATIC DISEASES, (OSTEO)ARTHRITIS, CACHEXIA, INFLAMMATORY BOWEL DISEASE, TOXIC SHOCK SYNDROME, SEPSIS, CROHN*S DISEASE, PSORIASIS AND GOUT TREATMENT MERCKLE GMBH (DE) 2002-08-13 US disclosed
US-4847270-A ANTIINFLAMMATORY AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1989-07-11 US disclosed
US-4728656-A ANTIARTHRITIC, ANTIINFLAMMATORY SMITHKLINE BECKMAN CORPORATION (US) 1988-03-01 US disclosed
WO-1988001168-A1 INHIBITION OF INTERLEUKIN-1 BY MONOCYTES AND/OR MACROPHAGES SMITHKLINE BECKMAN CORPORATION (US) 1988-02-25 WO disclosed
US-4175127-A ANTIARTHRITIC AGENTS SMITHKLINE CORPORATION (US) 1979-11-20 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 (4 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-20110028417-A1 Macrocyclic Compounds and Methods of Use Thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PCSK9, CYP11B2 MAPK14 3779/4885GCGR 1751/4885MAPK13 3611/4885
US-20170313661-A1 KINASE MODULATORS FOR THE TREATMENT OF CANCER MAP3K10, MAP3K12, MAP3K20 MAPK14 53/4885GCGR 3738/4885MAPK13 71/4885
US-20130045938-A1 KINASE MODULATORS FOR THE TREATMENT OF CANCER MAP3K10, MAP3K12, MAP3K20 MAPK14 53/4885GCGR 3738/4885MAPK13 71/4885
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics IL2, TPMT, IFNG MAPK14 3841/4885GCGR 2154/4885MAPK13 3803/4885

“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.