SCHEMBL4482646

SCHEMBL4482646

Cc1cccc(-c2[nH]c(C(N)=O)nc2-c2ccc3nn(C)nc3c2)n1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.52
MAPK14 Q16539 10/20 0.52
KDR P35968 2/20 0.52
RIPK2 O43353 1/20 0.52
ACVR1B P36896 1/20 0.52
PDGFRA P16234 1/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
PRKD1 Q15139 1/20 0.48
MTOR P42345 1/20 0.47

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
SCHEMBL4481445 0.83 TGFBR1 (0.53) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4486059 0.82 TGFBR1 (0.49) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4490527 0.81 TGFBR1 (0.52) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4490850 0.80 MAPK14 (0.47) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4495563 0.78 TGFBR1 (0.47) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4488865 0.78 TGFBR1 (0.47) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4481948 0.77 TGFBR1 (0.50) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL6761551 0.77 TGFBR1 (0.69) TGFBR1MAPK14RIPK2ACVR1B
SCHEMBL4487787 0.77 TGFBR1 (0.47) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL4483524 0.76 TGFBR1 (0.49) TGFBR1MAPK14KDRRIPK2ACVR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153872-B2 Imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2006-12-26 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
US-20040106608-A1 Novel imidazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-06-03 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-20040106608-A1 Novel imidazole compounds as transforming growth factor (TGF) inhibitors SMAD3, TGFBR1, TGFBR2 TGFBR1 2/4885MAPK14 290/4885KDR 267/4885
US-20070088037-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS TGFBR1, SMAD3, TGFBR2 TGFBR1 1/4885MAPK14 315/4885KDR 213/4885

“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.