SCHEMBL4490850

SCHEMBL4490850

Cc1cccc(-c2[nH]c(-c3ccc(O)cc3)nc2-c2ccc3nn(C)nc3c2)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.47
TGFBR1 P36897 13/20 0.47
CSNK1D P48730 2/20 0.47
MTOR P42345 1/20 0.47
CSNK1E P49674 1/20 0.47
JAK3 P52333 1/20 0.42
RIPK2 O43353 1/20 0.42
KDR P35968 1/20 0.42
ACVR1B P36896 1/20 0.42
NOX1 Q9Y5S8 1/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL4489424 0.87 TGFBR1 (0.54) MAPK14TGFBR1MTOR
SCHEMBL4481445 0.84 TGFBR1 (0.53) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4490527 0.82 TGFBR1 (0.52) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4490514 0.81 TGFBR1 (0.48) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4486059 0.81 TGFBR1 (0.49) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4482646 0.80 TGFBR1 (0.52) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4488865 0.79 TGFBR1 (0.47) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4481948 0.78 TGFBR1 (0.50) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4487787 0.78 TGFBR1 (0.47) MAPK14TGFBR1MTORRIPK2KDR
SCHEMBL4483524 0.77 TGFBR1 (0.49) MAPK14TGFBR1MTORRIPK2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070088037-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER INC. (US) 2007-04-19 US claimed
US-7635702-B2 Imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2009-12-22 US disclosed
US-20070088037-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER INC. (US) 2007-04-19 US disclosed
US-7153872-B2 Imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2006-12-26 US disclosed
CN-1681805-A Novel imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER PROD INC (US) 2005-10-12 CN disclosed
EP-1542990-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS Pfizer Products Inc. (US) 2005-06-22 EP disclosed
US-20040106608-A1 Novel imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-06-03 US disclosed
WO-2004026859-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PRODUCTS INC. (US) 2004-04-01 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 (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-20040106608-A1 Novel imidazole compounds as transforming growth factor (TGF) inhibitors SMAD3, TGFBR1, TGFBR2 MAPK14 290/4885TGFBR1 2/4885CSNK1D 1545/4885
US-20070088037-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS TGFBR1, SMAD3, TGFBR2 MAPK14 315/4885TGFBR1 1/4885CSNK1D 1619/4885

“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.