SCHEMBL19853813

SCHEMBL19853813

C=CC(=O)NCCCCOc1ccc(-c2ccc(C3CCC(CCCCC)CC3)cc2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.40
▸ ZDHHC20 Q5W0Z9 1/20 0.38
▸ ZDHHC2 Q9UIJ5 1/20 0.38
▸ ITK Q08881 1/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ BTK Q06187 2/20 0.35
▸ CCR2 P41597 2/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ S1PR1 P21453 4/20 0.35
▸ S1PR3 Q99500 3/20 0.35
▸ THRA P10827 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ S1PR2 O95136 1/20 0.35
▸ LPAR2 Q9HBW0 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ RARA P10276 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
SCHEMBL19855141 0.96 ITK (0.41) DGAT1ZDHHC20ZDHHC2ITKBTK
SCHEMBL19854444 0.92 BTK (0.40) DGAT1ITKBTKS1PR1ALDH1A1
SCHEMBL19856027 0.89 ITK (0.44) ZDHHC20ZDHHC2ITKBTKS1PR1
SCHEMBL19854169 0.89 RARA (0.40) DGAT1ZDHHC20ZDHHC2CNR2BTK
SCHEMBL19856050 0.86 ITK (0.43) ZDHHC20ZDHHC2ITKBTKS1PR1
SCHEMBL19854969 0.86 ITK (0.41) DGAT1ZDHHC20ZDHHC2ITKCNR2
SCHEMBL19855136 0.85 DGAT1 (0.40) DGAT1ZDHHC20ZDHHC2CNR2BTK
SCHEMBL19855059 0.85 THRA (0.41) ITKBTKPTPN11S1PR1S1PR3
SCHEMBL20370566 0.84 ZDHHC20 (0.48) DGAT1ZDHHC20ZDHHC2CCR2THRA
SCHEMBL19855117 0.84 BTK (0.43) DGAT1ZDHHC20ZDHHC2ITKBTK

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 DGAT1 4118/4885ZDHHC20 946/4885ZDHHC2 1841/4885
US-10662379-B2 Polymerizable polar compound, liquid crystal composition and liquid crystal display device SP1, MBD2, PAXBP1 DGAT1 4118/4885ZDHHC20 946/4885ZDHHC2 1841/4885

“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.

Send feedback