SCHEMBL19853891

SCHEMBL19853891

C=C(C)C(=O)N(C)CCOc1ccc(C2CCC(C3CCC(CCCCC)CC3)CC2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.40
▸ THRB P10828 3/20 0.40
▸ TDP1 Q9NUW8 1/20 0.37
▸ BTK Q06187 2/20 0.33
▸ KCNH2 Q12809 2/20 0.33
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ABCB11 O95342 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ TEC P42680 1/20 0.33
▸ TXK P42681 1/20 0.33
▸ BLK P51451 1/20 0.33
▸ BMX P51813 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ ITK Q08881 1/20 0.33
▸ ERBB4 Q15303 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ PPARG P37231 2/20 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
SCHEMBL19853897 0.88 BTK (0.43) THRATHRBTDP1BTKKCNH2
SCHEMBL19856040 0.85 RAB9A (0.46) CYP2C9RAB9AALDH1A1LMNAMAPT
SCHEMBL19854096 0.85 GPR119 (0.34) BTKKCNH2CYP2C9ALDH1A1LMNA
SCHEMBL19854088 0.85 OPRL1 (0.35) TDP1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL20370495 0.85 OPRL1 (0.35) TDP1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL19855894 0.85 BTK (0.44) THRATHRBTDP1BTKKCNH2
SCHEMBL19853830 0.85 OPRL1 (0.35) TDP1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL19853833 0.85 OPRL1 (0.35) TDP1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL19853834 0.85 OPRL1 (0.35) TDP1CYP2C9ALDH1A1LMNAMAPT
SCHEMBL19856052 0.84 EGFR (0.34) THRATHRBCYP2C9EGFRITK

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 THRA 3929/4885THRB 3939/4885TDP1 3883/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 THRA 3929/4885THRB 3939/4885TDP1 3883/4885

“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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