SCHEMBL5137971

SCHEMBL5137971

Cc1cccc(-c2[nH]c(-c3ccc(C(N)=O)cc3)nc2-c2ccc3nonc3c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 17/20 0.56
MAPK14 Q16539 4/20 0.54
RIPK2 O43353 2/20 0.54
KDR P35968 2/20 0.54
ACVR1B P36896 2/20 0.54
CSNK1D P48730 3/20 0.52
CSNK1E P49674 3/20 0.52
CSNK1A1 P48729 2/20 0.50
PRKD1 Q15139 2/20 0.50
CSNK1G2 P78368 1/20 0.50
CSNK1G1 Q9HCP0 1/20 0.50
KDM4E B2RXH2 1/20 0.50
PRKD3 O94806 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
MAPK1 P28482 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
SCHEMBL5138427 0.86 TGFBR1 (0.56) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL5497047 0.82 TGFBR1 (0.54) TGFBR1MAPK14RIPK2ACVR1BPRKD1
SCHEMBL5497694 0.82 TGFBR1 (0.75) TGFBR1MAPK14RIPK2ACVR1BCSNK1D
SCHEMBL5138613 0.80 MAPK14 (0.52) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL6760976 0.80 TGFBR1 (0.54) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL5162700 0.79 MAPK14 (0.51) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL5501622 0.79 MAPK14 (0.51) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL6760997 0.76 TGFBR1 (0.50) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL7250793 0.76 TGFBR1 (0.74) TGFBR1MAPK14RIPK2KDRACVR1B
SCHEMBL5138661 0.76 TGFBR1 (0.59) TGFBR1MAPK14RIPK2KDRACVR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6906089-B2 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2005-06-14 US claimed
EP-1268465-B1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2005-06-01 EP claimed
US-20030149277-A1 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION 2003-08-07 US claimed
EP-1268465-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-01-02 EP claimed
WO-2001072737-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-10-04 WO claimed
WO-2008013928-A2 TREATMENT OF CANCER WITH INTERFERON GENE DELIVERY IN COMBINATION WITH A TGF-BETA INHIBITOR BIOGEN IDEC MA INC. (US) 2008-01-31 WO disclosed
US-6906089-B2 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2005-06-14 US disclosed
EP-1268465-B1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2005-06-01 EP disclosed
US-20030149277-A1 Triarylimidazole derivatives as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION 2003-08-07 US disclosed
EP-1268465-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-01-02 EP disclosed
WO-2001072737-A1 TRIARYLIMIDAZOLE DERIVATIVES AS CYTOKINE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-10-04 WO 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-20030149277-A1 Triarylimidazole derivatives as cytokine inhibitors IL2, IL2RA, IL6ST TGFBR1 157/4885MAPK14 306/4885RIPK2 1792/4885

“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.