SCHEMBL30156172

SCHEMBL30156172

COc1ccc(-c2cnc3ccc(-c4c[nH]nc4-c4cccc(C)n4)nc3c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 1/20 0.43
▸ PDGFRA P16234 1/20 0.43
▸ TGFBR1 P36897 13/20 0.42
▸ HPGD P15428 1/20 0.38
▸ MAPK14 Q16539 2/20 0.37
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ MTOR P42345 1/20 0.36
▸ PIK3CA P42336 2/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIP5K1C O60331 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PI4KA P42356 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ PI4KB Q9UBF8 1/20 0.36
▸ MAP3K11 Q16584 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35

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
SCHEMBL25084915 1.00 PDGFRB (0.43) PDGFRBPDGFRATGFBR1HPGDMAPK14
SCHEMBL25084910 0.87 TGFBR1 (0.45) TGFBR1HPGDMAPK14MTOR
SCHEMBL30156722 0.87 TGFBR1 (0.45) TGFBR1HPGDMAPK14MTOR
SCHEMBL25085062 0.87 TGFBR1 (0.45) TGFBR1MAPK14MTOR
SCHEMBL30156063 0.87 TGFBR1 (0.45) TGFBR1MAPK14MTOR
SCHEMBL25084848 0.87 TGFBR1 (0.45) PDGFRBPDGFRATGFBR1MAPK14MTOR
SCHEMBL30155996 0.87 TGFBR1 (0.45) PDGFRBPDGFRATGFBR1MAPK14MTOR
SCHEMBL30156447 0.86 TGFBR1 (0.43) TGFBR1MAPK14MTOR
SCHEMBL25084909 0.86 TGFBR1 (0.43) TGFBR1MAPK14MTOR
SCHEMBL25084880 0.85 CYP2A6 (0.46) PDGFRBPDGFRATGFBR1MAPK14MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11590116-B2 Substituted pyridines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-02-28 — — 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 (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-11590116-B2 Substituted pyridines and methods of use ALK, ACVR1, ACVR2A PDGFRB 17/4885PDGFRA 44/4885TGFBR1 211/4885

“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.

Send feedback