SCHEMBL4068870

SCHEMBL4068870

Cc1cccc(-c2[nH]cnc2-c2ccc3ncccc3n2)n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 19/20 0.61
▸ MTOR P42345 1/20 0.44
▸ MAPK14 Q16539 3/20 0.41
▸ CCR1 P32246 1/20 0.38
▸ CCR8 P51685 1/20 0.38

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
SCHEMBL4069691 0.82 TGFBR1 (0.61) TGFBR1MTORMAPK14
SCHEMBL11992061 0.82 TGFBR1 (0.66) TGFBR1MAPK14CCR1CCR8
SCHEMBL23389776 0.81 TGFBR1 (0.43) TGFBR1MTORMAPK14CCR1CCR8
SCHEMBL29796572 0.81 TGFBR1 (0.43) TGFBR1MTORMAPK14CCR1CCR8
SCHEMBL23408107 0.81 TGFBR1 (0.43) TGFBR1MTORMAPK14CCR1CCR8
SCHEMBL29832164 0.80 TGFBR1 (0.64) TGFBR1MTORMAPK14
SCHEMBL4030048 0.77 TGFBR1 (0.78) TGFBR1MTORMAPK14
SCHEMBL4032513 0.77 TGFBR1 (0.78) TGFBR1MTORMAPK14
SCHEMBL4032092 0.76 TGFBR1 (0.59) TGFBR1MAPK14CCR1CCR8
SCHEMBL23389914 0.76 TGFBR1 (0.42) TGFBR1MTORMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542990-B1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PROD INC (US) 2009-06-17 — — EP claimed
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
EP-1542990-B1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PROD INC (US) 2009-06-17 — — EP 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
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 2/4885MTOR 81/4885MAPK14 290/4885
US-20070088037-A1 NOVEL IMIDAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS TGFBR1, SMAD3, TGFBR2 TGFBR1 1/4885MTOR 72/4885MAPK14 315/4885

“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.

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