SCHEMBL19804576

SCHEMBL19804576

C/C=C(\C)C(=O)OCc1cc(OCCO)ccc1-c1ccc(C2CCCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.37
APP P05067 1/20 0.37
PPARG P37231 4/20 0.36
PPARA Q07869 3/20 0.36
CSF1R P07333 1/20 0.36
LMNA P02545 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35
KCNH2 Q12809 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
PPARD Q03181 1/20 0.35
ALDH2 P05091 1/20 0.34
MAOA P21397 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
SCHEMBL19804651 0.89 FFAR4 (0.49) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19804773 0.86 FFAR4 (0.43) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19796847 0.86 FFAR4 (0.41) FFAR4CYP2C9ALDH2RAB9A
SCHEMBL19804766 0.83 FFAR4 (0.49) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19804634 0.80 FFAR4 (0.44) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19804599 0.80 FFAR4 (0.46) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19804748 0.80 CYP3A4 (0.43) FFAR4CYP3A4CYP2C9APPPPARG
SCHEMBL19804799 0.79 FFAR4 (0.45) FFAR4SMN1; SMN2MAPTCYP3A4CYP2C9
SCHEMBL19804771 0.78 FFAR4 (0.48) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4
SCHEMBL19804755 0.78 FFAR4 (0.42) FFAR4SMN1; SMN2MAPTALDH1A1CYP3A4

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 FFAR4 1715/4885SMN1; SMN2 3551/4885MAPT 2308/4885

“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.