SCHEMBL4866974

SCHEMBL4866974

Cc1cccc(-c2c(-c3ccc4nn(C)nc4n3)nc3scnn23)n1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 16/20 0.38
TGFBR2 P37173 1/20 0.32
MAP3K20 Q9NYL2 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
MAPK14 Q16539 3/20 0.31
CCR1 P32246 1/20 0.31
CCR8 P51685 1/20 0.31
THRB P10828 1/20 0.30

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
SCHEMBL4866956 1.00 TGFBR1 (0.38) TGFBR1TGFBR2MAP3K20ADORA2AADORA1
SCHEMBL4860142 0.83 TGFBR1 (0.38) TGFBR1TGFBR2MAP3K20MAPK14
SCHEMBL4860133 0.83 TGFBR1 (0.44) TGFBR1TGFBR2MAP3K20MAPK14
SCHEMBL4868262 0.81 PTGS2 (0.37) TGFBR1ADORA2AADORA1
SCHEMBL4868689 0.81 TGFBR1 (0.56) TGFBR1MAPK14
SCHEMBL4868702 0.81 TGFBR1 (0.56) TGFBR1MAPK14
SCHEMBL4864110 0.80 TGFBR1 (0.37) TGFBR1ADORA2AADORA1MAPK14CCR1
SCHEMBL4864096 0.80 TGFBR1 (0.37) TGFBR1ADORA2AADORA1MAPK14CCR1
SCHEMBL4866825 0.74 TGFBR1 (0.35) TGFBR1TGFBR2MAP3K20MAPK14
SCHEMBL4866821 0.74 TGFBR1 (0.40) TGFBR1TGFBR2MAP3K20MAPK14

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
EP-1601676-A2 FUSED IMIDAZOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS Pfizer Products Inc. (US) 2005-12-07 EP claimed
WO-2004078110-A2 FUSED IMIZADOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PRODUCTS INC. (US) 2004-09-16 WO claimed
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-09-09 US claimed
US-20080275235-A1 NOVEL FUSED HETEROAROMATIC COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER INC. (US) 2008-11-06 US disclosed
US-7417041-B2 Imidazopyrimidines as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2008-08-26 US disclosed
EP-1601676-A2 FUSED IMIDAZOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS Pfizer Products Inc. (US) 2005-12-07 EP disclosed
WO-2004078110-A2 FUSED IMIZADOLES AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PRODUCTS INC. (US) 2004-09-16 WO disclosed
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-09-09 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-20080275235-A1 NOVEL FUSED HETEROAROMATIC COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS TGFBR1, SMAD3, SMAD2 TGFBR1 1/4885TGFBR2 4/4885MAP3K20 408/4885
US-20040176390-A1 Novel fused heteroaromatic compounds as transforming growth factor (TGF) inhibitors SMAD3, TGFBR1, SMAD2 TGFBR1 2/4885TGFBR2 4/4885MAP3K20 441/4885

“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.