SCHEMBL6761391

SCHEMBL6761391

Cc1cccc(-c2nc(C)n(C)c2-c2ccc3nccnc3c2)n1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 20/20 0.62
▸ MAPK14 Q16539 2/20 0.59
▸ MTOR P42345 1/20 0.51

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
SCHEMBL6760981 0.86 TGFBR1 (0.58) TGFBR1MAPK14MTOR
SCHEMBL6759936 0.86 TGFBR1 (0.58) TGFBR1MAPK14MTOR
SCHEMBL4865043 0.79 TGFBR1 (0.59) TGFBR1MAPK14MTOR
SCHEMBL4878226 0.79 TGFBR1 (0.59) TGFBR1MAPK14MTOR
SCHEMBL14524733 0.78 TGFBR1 (0.57) TGFBR1MAPK14MTOR
SCHEMBL14576531 0.77 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL4868431 0.77 TGFBR1 (0.57) TGFBR1MAPK14MTOR
SCHEMBL30203968 0.77 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL4857758 0.77 TGFBR1 (0.56) TGFBR1MAPK14MTOR
SCHEMBL21277970 0.76 TGFBR1 (0.70) TGFBR1MAPK14MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040220230-A1 Pyridinylimidazoles SMITHKLINE BEECHAM P.L.C. 2004-11-04 — — US claimed
US-20040220230-A1 Pyridinylimidazoles SMITHKLINE BEECHAM P.L.C. 2004-11-04 — — US disclosed
US-20030166633-A1 Pyridinylimidazoles SMITHKLINE BEECHAM P.L.C. (GB) 2003-09-04 — — 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-20030166633-A1 Pyridinylimidazoles NR0B1, NR1I2, NR0B2 TGFBR1 431/4885MAPK14 3277/4885MTOR 3903/4885
US-20040220230-A1 Pyridinylimidazoles NR0B1, NR1I2, NR0B2 TGFBR1 485/4885MAPK14 3471/4885MTOR 4099/4885

“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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