SCHEMBL3949976

SCHEMBL3949976

Cc1ccc(Oc2ccnc(Cl)c2)c(Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 9/20 0.41
S1PR4 O95977 4/20 0.38
GRM5 P41594 1/20 0.35
SMARCA2 P51531 1/20 0.34
SMARCA4 P51532 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN9A Q15858 1/20 0.34
GCK P35557 1/20 0.33
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33

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
SCHEMBL3947048 0.88 TGFBR1 (0.53) TGFBR1S1PR4GRM5PDGFRBPDGFRA
SCHEMBL3943494 0.85 S1PR4 (0.48) TGFBR1S1PR4GRM5SMARCA2SMARCA4
SCHEMBL22186851 0.85 S1PR4 (0.51) TGFBR1S1PR4SMARCA2SMARCA4
SCHEMBL22186856 0.81 TGFBR1 (0.55) TGFBR1S1PR4GRM5
SCHEMBL22186414 0.81 TGFBR1 (0.38) TGFBR1S1PR4GRM5
SCHEMBL22186823 0.80 SYK (0.41) TGFBR1GRM5
SCHEMBL3950789 0.80 SYK (0.49) TGFBR1SCN9A
SCHEMBL22850819 0.80 TGFBR1 (0.57) TGFBR1S1PR4
SCHEMBL22186828 0.80 SYK (0.44) TGFBR1S1PR4SCN5ASCN9A
SCHEMBL22187103 0.80 SYK (0.46) TGFBR1S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 TGFBR1 1/4885S1PR4 549/4885GRM5 319/4885

“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.