SCHEMBL20370582

SCHEMBL20370582

C=C(C)C(=O)NCCc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCC)CC4)cc3)c(CC)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 7/20 0.40
▸ DGAT1 O75907 3/20 0.38
▸ FFAR4 Q5NUL3 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP2C9 P11712 1/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ ITGB3 P05106 1/20 0.33
▸ ITGA2B P08514 1/20 0.33
▸ MCHR1 Q99705 1/20 0.33

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
SCHEMBL20370580 0.96 SPHK1 (0.41) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL20370588 0.96 SPHK1 (0.41) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL20370471 0.94 SPHK1 (0.40) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL19855839 0.90 RARB (0.41) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL19854951 0.90 SPHK1 (0.40) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL19854441 0.89 SPHK1 (0.39) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL20370587 0.88 RAB9A (0.39) DGAT1FFAR4ALDH1A1LMNAMAPT
SCHEMBL19854509 0.88 SPHK1 (0.46) SPHK1ALDH1A1LMNAMAPTCYP2C9
SCHEMBL19855824 0.86 RARB (0.43) SPHK1DGAT1FFAR4ALDH1A1LMNA
SCHEMBL20370583 0.86 RARB (0.43) SPHK1DGAT1FFAR4ALDH1A1LMNA

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-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-05-26 — — US disclosed
US-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-07-12 — — US disclosed
US-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-07-12 — — 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 (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-20180195005-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE SP1, MBD2, PAXBP1 SPHK1 906/4885DGAT1 4118/4885FFAR4 2050/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 SPHK1 906/4885DGAT1 4118/4885FFAR4 2050/4885

“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.

Send feedback