SCHEMBL20370518

SCHEMBL20370518

C=CC(=O)N(C)CCOc1c(F)cc(-c2ccc(-c3ccc(C4CCC(CCCCC)CC4)cc3)cc2F)cc1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 17/20 0.44
▸ KCNH2 Q12809 2/20 0.44
▸ ABCB11 O95342 1/20 0.44
▸ EGFR P00533 1/20 0.44
▸ ERBB2 P04626 1/20 0.44
▸ TEC P42680 1/20 0.44
▸ TXK P42681 1/20 0.44
▸ BLK P51451 1/20 0.44
▸ BMX P51813 1/20 0.44
▸ JAK3 P52333 1/20 0.44
▸ ITK Q08881 1/20 0.44
▸ ERBB4 Q15303 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44
▸ CYP2D6 P10635 1/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ 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
SCHEMBL19854626 0.92 BTK (0.41) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854043 0.91 BTK (0.40) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854035 0.89 BTK (0.41) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854999 0.88 BTK (0.39) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL20370528 0.88 BTK (0.39) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19855481 0.88 BTK (0.40) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854621 0.86 RARB (0.41) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19855117 0.85 BTK (0.43) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854624 0.85 RARB (0.42) BTKKCNH2ABCB11EGFRERBB2
SCHEMBL19854629 0.85 RARB (0.42) BTKKCNH2ABCB11EGFRERBB2

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 BTK 4463/4885KCNH2 1926/4885ABCB11 4627/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 BTK 4463/4885KCNH2 1926/4885ABCB11 4627/4885

“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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