SCHEMBL19796446

SCHEMBL19796446

C=CC(=O)OCCc1cc(CCCCCCC)ccc1-c1ccc(OCCO)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPK1 P28482 1/20 0.48
CASP1 P29466 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SLCO1B3 Q9NPD5 1/20 0.48
SLCO1B1 Q9Y6L6 1/20 0.48
PTPN11 Q06124 2/20 0.44
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
THRA P10827 4/20 0.40
RARB P10826 5/20 0.40
PLA2G4A P47712 1/20 0.39

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
SCHEMBL19796900 0.94 THRB (0.51) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796386 0.85 THRB (0.51) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796898 0.85 THRB (0.52) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796837 0.84 RARB (0.48) THRBMEN1KMT2AALDH1A1HPGD
SCHEMBL19796840 0.84 THRB (0.47) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796838 0.83 RARB (0.49) THRBMEN1KMT2AHPGDTSHR
SCHEMBL19796444 0.83 THRB (0.48) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796927 0.83 THRB (0.52) THRBMEN1KMT2AUSP2ALDH1A1
SCHEMBL19796967 0.83 RARB (0.48) THRBMEN1KMT2AHPGDTSHR
SCHEMBL19796833 0.83 THRB (0.48) THRBMEN1KMT2AALDH1A1HPGD

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 4323/4885MEN1 1151/4885KMT2A 3392/4885

“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.