SCHEMBL18308742

SCHEMBL18308742

Cc1cc(-c2ccc(P)cc2)ccc1-c1ccc(P)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HSD17B1 P14061 2/20 0.39
▸ ESR1 P03372 1/20 0.38
▸ SLC2A1 P11166 1/20 0.36
▸ HSD17B2 P37059 1/20 0.34
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ PDE3B Q13370 2/20 0.33
▸ PDE3A Q14432 2/20 0.33
▸ MAPT P10636 1/20 0.31
▸ RARB P10826 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ DAPK3 O43293 1/20 0.31
▸ NTRK1 P04629 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
SCHEMBL18308786 0.94 ESR2 (0.37) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308763 0.94 ESR2 (0.37) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308754 0.91 ESR2 (0.41) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308767 0.90 ESR2 (0.39) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308740 0.88 ESR2 (0.42) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308753 0.88 ESR2 (0.38) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308762 0.87 RARB (0.35) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308748 0.87 RARB (0.35) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308787 0.87 ESR2 (0.40) ESR2ALDH1A1TDP1HSD17B1ESR1
SCHEMBL18308749 0.86 ESR2 (0.43) ESR2ALDH1A1CYP3A4TSHRTDP1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-08 — — US disclosed
US-20230183571-A1 LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS MERCK PATENT GMBH (DE) 2023-06-15 — — US disclosed
EP-3275973-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2019-12-18 — — EP disclosed
US-20180201837-A1 Method of Reducing ODF Mura in Polymer Stabilised Liquid Crystal Displays MERCK PATENT GMBH (DE) 2018-07-19 — — US disclosed
EP-3275973-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-01-31 — — EP disclosed
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS GMBH, MERCK PATENT (DE) 2017-05-04 — — US disclosed
EP-3121247-A1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS Merck Patent GmbH (DE) 2017-01-25 — — EP disclosed
WO-2017008884-A1 METHOD OF REDUCING ODF MURA IN POLYMER STABILISED LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2017-01-19 — — WO disclosed
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2016-12-15 — — 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 (3 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-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays VCL, ILK, LCP1 ESR2 4146/4885ALDH1A1 4572/4885CYP3A4 1699/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C ESR2 4322/4885ALDH1A1 4590/4885CYP3A4 2477/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ESR2 4381/4885ALDH1A1 4429/4885CYP3A4 2115/4885

“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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