SCHEMBL19804307

SCHEMBL19804307

C=C(C)C(=O)OCc1cc(-c2ccc(CCO)cc2)ccc1C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.40
CYP4A11 Q02928 3/20 0.40
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RARB P10826 1/20 0.34
HSD17B1 P14061 1/20 0.33
FFAR1 O14842 2/20 0.33
PPARA Q07869 1/20 0.33
CA2 P00918 2/20 0.33
PTGER4 P35408 1/20 0.32
MCL1 Q07820 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
CA1 P00915 1/20 0.31
THRB P10828 1/20 0.31
PTGS2 P35354 2/20 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
SCHEMBL19804204 0.93 CYP4A11 (0.38) CYP4F2CYP4A11MEN1KMT2ARARB
SCHEMBL19804224 0.90 PTGER4 (0.40) CYP4F2CYP4A11MEN1KMT2AHSD17B1
SCHEMBL19804322 0.89 THRB (0.39) CYP4F2CYP4A11RARBPPARACA2
SCHEMBL19796460 0.85 CYP4F2 (0.38) CYP4F2CYP4A11RARBHSD17B1MCL1
SCHEMBL19804668 0.84 FFAR1 (0.42) FFAR1PTGER4
SCHEMBL19804382 0.84 POLB (0.44) MEN1KMT2AFFAR1PPARAPTGER4
SCHEMBL19796225 0.83 MCL1 (0.40) CYP4F2CYP4A11RARBHSD17B1MCL1
SCHEMBL19624374 0.82 CYP4F2 (0.40) CYP4F2CYP4A11RARBFFAR1PPARA
SCHEMBL19804538 0.82 S1PR1 (0.37) FFAR1PPARAHCAR2
SCHEMBL19624572 0.82 MEN1 (0.37) CYP4F2CYP4A11MEN1KMT2AFFAR1

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 CYP4F2 2577/4885CYP4A11 1991/4885MEN1 1151/4885

“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.