SCHEMBL4980404

SCHEMBL4980404

CCC(CO)n1cnc(-c2ccc(F)cc2)c1-c1ccnc(Oc2ccc(Cl)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.56
MAPT P10636 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
TGFBR1 P36897 4/20 0.48
TGFBR2 P37173 1/20 0.48
BRD4 O60885 1/20 0.48
BRDT Q58F21 1/20 0.48

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
SCHEMBL4982485 1.00 MAPK14 (0.56) MAPK14MAPTL3MBTL1TGFBR1TGFBR2
SCHEMBL4982803 1.00 MAPK14 (0.56) MAPK14MAPTL3MBTL1TGFBR1TGFBR2
SCHEMBL4982718 0.92 MAPK14 (0.57) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4986282 0.92 MAPK14 (0.57) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4982712 0.92 MAPK14 (0.57) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL7827952 0.91 MAPK14 (0.56) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4984673 0.91 MAPK14 (0.58) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4987897 0.91 MAPK14 (0.58) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4984676 0.91 MAPK14 (0.58) MAPK14TGFBR1TGFBR2BRD4BRDT
SCHEMBL4987831 0.90 MAPK14 (0.59) MAPK14MAPTL3MBTL1BRD4BRDT

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-20030114452-A1 Novel substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION 2003-06-19 US claimed
US-20080114010-A1 Novel Substituted Imidazole Compounds SMITHKLINE BEECHAM CORPORATION 2008-05-15 US disclosed
US-7301021-B2 Substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION (US) 2007-11-27 US disclosed
US-20030114452-A1 Novel substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION 2003-06-19 US disclosed
US-6489325-B1 INHIBITORS OF CSBP/P38, ONE OF SEVERAL KINASES INVOLVED IN A STRESS-RESPONSE SIGNAL TRANSDUCTION, DECREASE THE SYNTHESIS OF A WIDE VARIETY OF PRO-INFLAMMATORY PROTEINS INCLUDING, IL-6, IL-8, GM-CSF, AND COX-2 SMITHKLINE BEECHAM CORPORATION 2002-12-03 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 (2 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-20030114452-A1 Novel substituted imidazole compounds CREBBP, MAPKAPK2, ATF1 MAPK14 70/4885MAPT 1315/4885L3MBTL1 1453/4885
US-20080114010-A1 Novel Substituted Imidazole Compounds CREBBP, MAPKAPK2, ATF1 MAPK14 70/4885MAPT 1315/4885L3MBTL1 1453/4885

“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.