SCHEMBL20370600

SCHEMBL20370600

C=CC(=O)NC1CCC(c2ccc(C3CCC(C4CCC(CCCCC)CO4)CC3)cc2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 1/20 0.35
▸ CCR2 P41597 4/20 0.34
▸ CDK7 P50613 3/20 0.34
▸ CDK13 Q14004 3/20 0.34
▸ CDK12 Q9NYV4 3/20 0.34
▸ DRD2 P14416 4/20 0.32
▸ HTR2A P28223 4/20 0.32
▸ DRD3 P35462 4/20 0.32
▸ OPRL1 P41146 5/20 0.32
▸ TEAD1 P28347 1/20 0.31

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
SCHEMBL19855281 0.90 OPRL1 (0.37) SMYD3CCR2CDK7CDK13CDK12
SCHEMBL20370544 0.90 OPRL1 (0.37) SMYD3CCR2CDK7CDK13CDK12
SCHEMBL20370556 0.90 OPRL1 (0.37) SMYD3CCR2CDK7CDK13CDK12
SCHEMBL20370548 0.90 OPRL1 (0.37) SMYD3CCR2CDK7CDK13CDK12
SCHEMBL20374685 0.85 OPRL1 (0.31) OPRL1
SCHEMBL19855478 0.85 BTK (0.32) OPRL1
SCHEMBL21322094 0.84 S1PR1 (0.33) DRD2DRD3OPRL1
SCHEMBL19855929 0.83 SMYD3 (0.35) SMYD3CCR2TEAD1
SCHEMBL20370569 0.83 FASN (0.39) SMYD3CCR2CDK7CDK13CDK12
SCHEMBL19722605 0.81 OPRL1 (0.31) OPRL1

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 SMYD3 695/4885CCR2 61/4885CDK7 337/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 SMYD3 695/4885CCR2 61/4885CDK7 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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