SCHEMBL19722155

SCHEMBL19722155

C=C(CO)C(=O)OCCCc1ccc(-c2ccc(C3CCC(CCCCC)CC3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.42
CYP2C9 P11712 1/20 0.38
SPHK2 Q9NRA0 7/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
RARB P10826 2/20 0.36

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
SCHEMBL19721820 0.97 SPHK1 (0.44) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19722554 0.96 SPHK1 (0.43) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19722051 0.96 SPHK1 (0.43) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19722414 0.94 SPHK1 (0.42) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19755066 0.94 SPHK1 (0.42) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL20313627 0.93 CYP2C9 (0.36) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19722420 0.93 SPHK1 (0.41) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19722314 0.93 SPHK1 (0.47) SPHK1CYP2C9SPHK2ALDH1A1LMNA
SCHEMBL19755088 0.93 CYP2C9 (0.42) SPHK1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL19722527 0.92 FFAR4 (0.39) SPHK1CYP2C9SPHK2RARB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 US disclosed
US-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element JNC CORPORATION (JP) 2019-08-27 US disclosed
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2017-12-28 US disclosed
EP-3257839-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2017-12-20 EP 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 (2 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-10392339-B2 Polymerizable polar compound, liquid crystal composition, and liquid crystal display element SP1, HVCN1, CXCR1 SPHK1 435/4885CYP2C9 4226/4885SPHK2 663/4885
US-20170369418-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, SPIN1, SAV1 SPHK1 646/4885CYP2C9 4442/4885SPHK2 790/4885

“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.