SCHEMBL5198622

SCHEMBL5198622

Cc1cccc(-c2n[nH]cc2-c2ccc(F)c(-c3ccc(C(C)O)cn3)c2)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 16/20 0.40
TGFBR2 P37173 1/20 0.33
THRB P10828 1/20 0.32
MAPK14 Q16539 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GABRA1 P14867 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31

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
SCHEMBL5198168 0.84 TGFBR1 (0.41) TGFBR1TGFBR2THRBMAPK14CYP1A2
SCHEMBL5198303 0.83 TGFBR1 (0.40) TGFBR1TGFBR2THRBMAPK14GABRA1
SCHEMBL5199998 0.82 TGFBR1 (0.42) TGFBR1TGFBR2MAPK14CYP1A2CYP2D6
SCHEMBL5199509 0.81 TGFBR1 (0.38) TGFBR1TGFBR2THRBMAPK14CYP1A2
SCHEMBL5198088 0.81 TGFBR1 (0.38) TGFBR1TGFBR2THRBMAPK14CYP1A2
SCHEMBL5199536 0.81 TGFBR1 (0.38) TGFBR1TGFBR2THRBGABRA1GABRG2
SCHEMBL5198246 0.80 TGFBR1 (0.39) TGFBR1TGFBR2THRBMAPK14CYP1A2
SCHEMBL5200352 0.79 TGFBR1 (0.42) TGFBR1TGFBR2THRBMAPK14CYP1A2
SCHEMBL5200314 0.79 TGFBR1 (0.44) TGFBR1THRBMAPK14CYP1A2CYP2D6
SCHEMBL5201354 0.79 TGFBR1 (0.46) TGFBR1TGFBR2THRBMAPK14

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 40/4885TGFBR2 51/4885THRB 839/4885

“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.