SCHEMBL19855281

SCHEMBL19855281

C=CC(=O)NC1CCC(C2CCC(c3ccc(C4CCC(CCCCC)CC4)cc3F)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 9/20 0.37
▸ SMYD3 Q9H7B4 1/20 0.37
▸ CDK7 P50613 3/20 0.37
▸ CDK13 Q14004 3/20 0.37
▸ CDK12 Q9NYV4 3/20 0.37
▸ CCR2 P41597 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TEAD1 P28347 2/20 0.35
▸ CYP2C9 P11712 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
SCHEMBL20370556 1.00 OPRL1 (0.37) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370544 1.00 OPRL1 (0.37) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370548 1.00 OPRL1 (0.37) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370569 0.90 FASN (0.39) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370600 0.90 SMYD3 (0.35) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370552 0.90 SMYD3 (0.38) SMYD3CDK7CDK13CDK12ALDH1A1
SCHEMBL20370558 0.90 SMYD3 (0.38) SMYD3CDK7CDK13CDK12ALDH1A1
SCHEMBL20370549 0.90 SMYD3 (0.38) OPRL1SMYD3CDK7CDK13CDK12
SCHEMBL20370608 0.89 CDK7 (0.36) SMYD3CDK7CDK13CDK12CCR2
SCHEMBL19855278 0.89 ZDHHC20 (0.39) OPRL1ALDH1A1LMNAMAPTCYP2C9

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 OPRL1 3416/4885SMYD3 695/4885CDK7 337/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 OPRL1 3416/4885SMYD3 695/4885CDK7 337/4885

“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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