SCHEMBL21363867

SCHEMBL21363867

Cc1cc(-c2ncccc2-c2cn3ncnc3cc2Cl)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.39
MAPK13 O15264 3/20 0.37
MAPK12 P53778 3/20 0.37
MAPK11 Q15759 3/20 0.37
MAPK14 Q16539 3/20 0.37
EGLN2 Q96KS0 1/20 0.37
GRIN2B Q13224 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KDR P35968 3/20 0.35
EGFR P00533 2/20 0.35
KCNH2 Q12809 1/20 0.35
CHRM5 P08912 1/20 0.35
TGFBR1 P36897 6/20 0.35
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34

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
SCHEMBL15637970 0.90 PDE4A (0.38) KMOMAPK13MAPK12MAPK11MAPK14
SCHEMBL21363870 0.90 TGFBR1 (0.40) KMOMAPK14EGLN2SLC6A2SLC6A4
SCHEMBL15638088 0.87 TGFBR1 (0.40) KMOKDM4EALDH1A1MAPK1SLC6A2
SCHEMBL30117480 0.84 TGFBR1 (0.47) MAPK14TGFBR1DYRK1ATGFBR2
SCHEMBL15639413 0.84 TGFBR1 (0.47) MAPK14TGFBR1DYRK1ATGFBR2
SCHEMBL21363871 0.83 EGLN2 (0.43) EGLN2KDRTGFBR1JAK2MAP4K4
SCHEMBL15640129 0.83 TGFBR1 (0.46) KMOGRIN2BTGFBR1FLT3
SCHEMBL21363868 0.82 EGLN2 (0.39) MAPK14EGLN2SLC6A2SLC6A4SLC6A3
SCHEMBL16473298 0.81 TGFBR1 (0.43) KMOMAPK13MAPK12MAPK11MAPK14
SCHEMBL21363872 0.81 SLC6A2 (0.38) KMOEGLN2SLC6A2SLC6A4SLC6A3

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-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2019-09-19 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-20190284155-A1 2,3-Disubstituted Pyridine Compounds as TGF-Beta Inhibitors and Methods of Use TGFBR2, ACVR1, TGFBR1 KMO 2964/4885MAPK13 1550/4885MAPK12 1304/4885

“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.