SCHEMBL19796342

SCHEMBL19796342

C=C(C)C(=O)OCCOc1cc(CCO)ccc1-c1ccc(CCC)cc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
TSHR P16473 2/20 0.35
S1PR1 P21453 2/20 0.34
LTB4R Q15722 1/20 0.34
POLB P06746 2/20 0.33
RARB P10826 2/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL19796349 0.94 CYP4F2 (0.37) THRBCYP4F2CYP4A11TSHRS1PR1
SCHEMBL19796329 0.94 THRB (0.35) THRBCYP4F2CYP4A11TSHRS1PR1
SCHEMBL19804215 0.90 CA1 (0.35) THRBCYP4F2CYP4A11TSHRPOLB
SCHEMBL19796430 0.90 POLB (0.38) THRBPOLBRARBAPEX1HTT
SCHEMBL19796341 0.89 CYP11B1 (0.37) THRBCYP4F2CYP4A11TSHRLTB4R
SCHEMBL19796422 0.89 CYP11B1 (0.37) THRBCYP4F2CYP4A11TSHRLTB4R
SCHEMBL19796797 0.87 RARB (0.47) THRBTSHRS1PR1RARBHTT
SCHEMBL19796226 0.85 LTB4R (0.39) THRBTSHRS1PR1LTB4RRARB
SCHEMBL19804118 0.84 CA1 (0.36) CYP4F2CYP4A11TSHRPOLBAPEX1
SCHEMBL19796420 0.83 THRB (0.38) THRBCYP4F2CYP4A11TSHRLTB4R

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-20180023001-A1 COMPOUND HAVING POLYMERIZABLE GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 US disclosed
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 4323/4885CYP4F2 2577/4885CYP4A11 1991/4885

“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.