SCHEMBL5198328

SCHEMBL5198328

Cc1cccc(-c2[nH]c(C(C)C)nc2-c2cccc(-c3ccc(CN4CCOCC4)cc3)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 9/20 0.49
MAPK14 Q16539 6/20 0.44
TLR8 Q9NR97 2/20 0.42
TLR7 Q9NYK1 2/20 0.42
HRH3 Q9Y5N1 2/20 0.42
TNKS O95271 1/20 0.41
ALOX5 P09917 1/20 0.40
JAK2 O60674 1/20 0.40
RIPK2 O43353 1/20 0.39
ACVR1B P36896 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CNR2 P34972 1/20 0.39
CHEK1 O14757 1/20 0.38

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
SCHEMBL5200190 0.90 TGFBR1 (0.42) TGFBR1TLR8TLR7TNKSCHEK1
SCHEMBL6251548 0.90 TGFBR1 (0.62) TGFBR1MAPK14TNKSALOX5JAK2
SCHEMBL5201014 0.89 TGFBR1 (0.46) TGFBR1MAPK14TNKSALOX5JAK2
SCHEMBL5200006 0.82 TGFBR1 (0.45) TGFBR1MAPK14RIPK2ACVR1BTDP1
SCHEMBL5201026 0.82 TGFBR1 (0.49) TGFBR1JAK2
SCHEMBL5198378 0.80 TGFBR1 (0.61) TGFBR1MAPK14RIPK2ACVR1BTDP1
SCHEMBL5199866 0.80 TGFBR1 (0.48) TGFBR1MAPK14RIPK2ACVR1BTDP1
SCHEMBL5197656 0.79 TGFBR1 (0.52) TGFBR1MAPK14
SCHEMBL5199441 0.78 TGFBR1 (0.47) TGFBR1MAPK14RIPK2ACVR1BTDP1
SCHEMBL5201273 0.78 TGFBR1 (0.47) TGFBR1MAPK14RIPK2ACVR1BTDP1

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-20070275968-A1 Substituted Biphenyl Derivative SANKYO COMPANY, LIMITED (JP) 2007-11-29 US disclosed
EP-1798229-A1 SUBSTITUTED BIPHENYL DERIVATIVE Sankyo Company, Limited (JP) 2007-06-20 EP 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 40/4885MAPK14 2998/4885TLR8 2599/4885

“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.