SCHEMBL19854713

SCHEMBL19854713

C=C(C)C(=O)OCCC(CCOC(=O)C(=C)CO)c1ccc(-c2ccc(C3CCC(CCCCC)CC3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ FFAR1 O14842 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ DGAT1 O75907 2/20 0.31
▸ SOAT1 P35610 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ACACB O00763 2/20 0.30
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ GAA P10253 1/20 0.30
▸ PTGER2 P43116 3/20 0.30
▸ PTGER4 P35408 1/20 0.30
▸ PTGER3 P43115 1/20 0.30
▸ P2RY14 Q15391 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL21398409 0.95 CYP2C9 (0.37) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL21398164 0.93 TSHR (0.36) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL19856079 0.93 TSHR (0.39) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL20882304 0.91 CYP2C9 (0.36) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL19855707 0.90 TSHR (0.37) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL21398717 0.90 TSHR (0.38) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL19855045 0.89 CYP2C9 (0.41) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL19855605 0.88 ACACB (0.34) CYP2C9MAPTALDH1A1LMNACA1
SCHEMBL19854795 0.88 TSHR (0.33) TSHRCYP2C9MAPTALDH1A1LMNA
SCHEMBL21398126 0.88 TSHR (0.35) TSHRCYP2C9MAPTALDH1A1LMNA

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 3 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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORPORATION (JP) 2019-09-26 — — 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 (1 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-20190292463-A1 POLYMERIZABLE POLAR COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT SP1, PYM1, MPEG1 TSHR 3095/4885CYP2C9 4670/4885MAPT 2338/4885

“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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