SCHEMBL5452666

SCHEMBL5452666

Cc1cccc(-c2nc(C(C)C)[nH]c2-c2ccc(F)c(-c3ccc(NS(=O)(=O)C4CC4)cc3)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.41
KDM5B Q9UGL1 1/20 0.40
MAP2K4 P45985 3/20 0.38
KIT P10721 5/20 0.37
MAP2K7 O14733 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
SCN9A Q15858 1/20 0.34
AAK1 Q2M2I8 2/20 0.34
SGK1 O00141 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK2 O60674 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
SCHEMBL5450527 0.93 TGFBR1 (0.48) TGFBR1KDM5BMAP2K4KITMAP2K7
SCHEMBL5198289 0.82 TGFBR1 (0.51) TGFBR1KDM5BMAP2K4KITMAP2K7
SCHEMBL5199678 0.81 MAP2K4 (0.42) TGFBR1KDM5BMAP2K4KITMAP2K7
SCHEMBL5200698 0.81 TGFBR1 (0.45) TGFBR1KDM5BMAP2K4KITMAP2K7
SCHEMBL5198507 0.77 TGFBR1 (0.49) TGFBR1ALOX5APFEN1
SCHEMBL5199505 0.76 TGFBR1 (0.48) TGFBR1KDM5BMAP2K4KITMAP2K7
SCHEMBL5199625 0.75 TGFBR1 (0.43) TGFBR1
SCHEMBL5199945 0.75 TGFBR1 (0.43) TGFBR1
SCHEMBL5198579 0.75 TGFBR1 (0.40) TGFBR1
SCHEMBL5197872 0.74 TGFBR1 (0.43) TGFBR1

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-20070275968-A1 Substituted Biphenyl Derivative SANKYO COMPANY, LIMITED (JP) 2007-11-29 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-20070275968-A1 Substituted Biphenyl Derivative COL2A1, COL1A1, FGFR3 TGFBR1 40/4885KDM5B 275/4885MAP2K4 3435/4885

“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.