SCHEMBL19804371

SCHEMBL19804371

C=CC(=O)OCCOc1cc(C)ccc1-c1ccc(CO)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.44
FFAR4 Q5NUL3 3/20 0.42
HPGD P15428 1/20 0.38
FFAR1 O14842 2/20 0.38
TSHR P16473 4/20 0.37
PPARG P37231 1/20 0.37
ALDH1A1 P00352 5/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPK1 P28482 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
MAP2K4 P45985 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 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
SCHEMBL19804130 0.94 FFAR4 (0.44) THRBFFAR4FFAR1TSHRALDH1A1
SCHEMBL19796448 0.93 FFAR4 (0.43) THRBFFAR4HPGDFFAR1TSHR
SCHEMBL19804193 0.88 THRB (0.51) THRBFFAR4HPGDFFAR1TSHR
SCHEMBL19796433 0.87 THRB (0.46) THRBFFAR4HPGDTSHRALDH1A1
SCHEMBL19796378 0.86 THRB (0.48) THRBFFAR4HPGDTSHRALDH1A1
SCHEMBL19804271 0.84 THRB (0.52) THRBFFAR4FFAR1ALDH1A1KDM4E
SCHEMBL19804171 0.84 FFAR4 (0.42) THRBFFAR4FFAR1TSHRPPARG
SCHEMBL19804021 0.84 FFAR4 (0.40) THRBFFAR4HPGDFFAR1TSHR
SCHEMBL19804022 0.83 THRB (0.42) THRBFFAR4L3MBTL1LMNAPTGDR2
SCHEMBL19796892 0.82 THRB (0.50) THRBHPGDTSHRALDH1A1MAPT

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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, C1S, AP3D1 THRB 4323/4885FFAR4 1715/4885HPGD 4741/4885

“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.