SCHEMBL17754308

SCHEMBL17754308

C=C(C)C(=O)COc1ccc(-c2ccc(OCC(=O)C(=C)C)c(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.48
PPARD Q03181 12/20 0.48
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
PPARA Q07869 3/20 0.41
NR1H4 Q96RI1 1/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PPARG P37231 1/20 0.40
LMNA P02545 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
SCHEMBL17754314 0.86 RARA (0.41) FFAR1RARARARBMAPTLMNA
SCHEMBL17754306 0.85 MAPT (0.49) MAPTALDH1A1LMNA
SCHEMBL20312018 0.83 GPR174 (0.41) FFAR1PPARDRARARARBMAPT
SCHEMBL19882314 0.83 GPR174 (0.41) FFAR1PPARDRARARARBMAPT
SCHEMBL19636594 0.82 FFAR1 (0.43) FFAR1PPARDPPARANR1H4MAPT
SCHEMBL21470071 0.81 RARA (0.44) FFAR1PPARDRARARARBPPARA
SCHEMBL18503392 0.80 FFAR1 (0.41) FFAR1PPARDRARARARBPPARA
SCHEMBL21469890 0.80 RARB (0.42) FFAR1PPARDRARARARBPPARA
SCHEMBL20311779 0.80 RARB (0.42) FFAR1PPARDRARARARBPPARA
SCHEMBL16982209 0.79 POLB (0.48) FFAR1PPARDRARARARBPPARA

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-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME DIC CORPORATION (JP) 2016-05-19 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-20160137921-A1 POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL COMPOSITION PRODUCED USING SAME RCC1, LPXN, SMC4 FFAR1 1525/4885PPARD 4473/4885RARA 3185/4885

“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.