SCHEMBL19796330

SCHEMBL19796330

C=C(C)C(=O)Oc1cc(CO)ccc1-c1ccc(CCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
THRB P10828 3/20 0.40
MCL1 Q07820 1/20 0.38
RARB P10826 2/20 0.36
THRA P10827 1/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
BACE1 P56817 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
ALOX5 P09917 2/20 0.34
CNR2 P34972 1/20 0.34
PLK1 P53350 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 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
SCHEMBL19796421 0.95 THRB (0.40) CYP4F2CYP4A11THRBMCL1RARB
SCHEMBL19796325 0.87 CYP11B1 (0.38) CYP4F2CYP4A11THRBMCL1RARB
SCHEMBL19803994 0.86 CYP4F2 (0.44) CYP4F2CYP4A11FFAR4BACE1ALDH1A1
SCHEMBL19796865 0.84 THRB (0.46) THRBRARBTHRAALDH1A1MAPT
SCHEMBL19796426 0.84 ALDH1A1 (0.44) THRBACACBBACE1ALDH1A1MAPT
SCHEMBL19796420 0.82 THRB (0.38) CYP4F2CYP4A11THRBRARBFFAR4
SCHEMBL19804013 0.81 FFAR4 (0.39) CYP4F2CYP4A11FFAR4BACE1ALDH1A1
SCHEMBL19796316 0.81 FFAR4 (0.36) THRBMCL1RARBTHRAACACB
SCHEMBL15385603 0.81 THRB (0.40) THRBMCL1RARBTHRAACACB
SCHEMBL19796318 0.80 THRB (0.38) THRBMCL1RARBTHRAACACB

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 CYP4F2 2577/4885CYP4A11 1991/4885THRB 4323/4885

“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.