SCHEMBL19853832

SCHEMBL19853832

C=CC(=O)N(C)C1CCC(C2CCC(c3ccc(C4CCC(CCCCC)CC4)cc3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 1/20 0.43
▸ SPHK1 Q9NYA1 3/20 0.42
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ LSS P48449 6/20 0.39
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ESR2 Q92731 1/20 0.34
▸ CCR2 P41597 1/20 0.32

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
SCHEMBL19854093 1.00 CYP2C9 (0.43) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL19854467 0.97 CYP2C9 (0.45) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL20370533 0.94 SPHK1 (0.47) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL20370504 0.93 CYP2C9 (0.43) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL20370537 0.90 LSS (0.42) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL20370423 0.89 LSS (0.38) CYP2C9MAPTLSSMEN1KMT2A
SCHEMBL19854496 0.89 LSS (0.38) CYP2C9MAPTLSSMEN1KMT2A
SCHEMBL20370486 0.89 LSS (0.38) CYP2C9MAPTLSSMEN1KMT2A
SCHEMBL20370496 0.89 MGLL (0.35) CYP2C9SPHK1MAPTALDH1A1LMNA
SCHEMBL19853836 0.89 CYP2C9 (0.34) CYP2C9SPHK1MAPTALDH1A1LMNA

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 5 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
WO-2018025974-A1 LIQUID-CRYSTAL DISPLAY ELEMENT AND DISPLAY DEVICE JNC株式会社 2018-02-08 — — WO 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 CYP2C9 3761/4885SPHK1 906/4885MAPT 1073/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 CYP2C9 3761/4885SPHK1 906/4885MAPT 1073/4885

“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.

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