SCHEMBL18308767

SCHEMBL18308767

Cc1ccc(-c2ccc(-c3ccc(P)cc3)cc2C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ MCL1 Q07820 1/20 0.37
▸ PTGS2 P35354 3/20 0.37
▸ PTGS1 P23219 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HTR7 P34969 2/20 0.35
▸ ADORA1 P30542 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ HSD17B1 P14061 1/20 0.33

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
SCHEMBL26173307 0.90 ESR2 (0.40) ESR2ESR1MCL1PTGS2PTGS1
SCHEMBL18308742 0.90 ESR2 (0.41) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308739 0.89 MCL1 (0.42) MCL1PTGS2PTGS1ALDH1A1CYP3A4
SCHEMBL18308760 0.89 MCL1 (0.42) MCL1PTGS2PTGS1ALDH1A1CYP3A4
SCHEMBL18308753 0.86 ESR2 (0.38) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308763 0.84 ESR2 (0.37) ESR2ESR1MCL1PTGS2ALDH1A1
SCHEMBL18308786 0.84 ESR2 (0.37) ESR2ESR1MCL1PTGS2ALDH1A1
SCHEMBL18308747 0.82 ESR2 (0.35) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18621842 0.82 HSD17B1 (0.44) ESR2ESR1MCL1ALDH1A1CYP3A4
SCHEMBL18308754 0.81 ESR2 (0.41) ESR2ESR1ALDH1A1CYP3A4TSHR

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-11718791-B2 Polymerisable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2023-08-08 — — US disclosed
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS GMBH, MERCK PATENT (DE) 2017-05-04 — — US 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 4146/4885ESR1 2744/4885MCL1 1595/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C ESR2 4322/4885ESR1 2626/4885MCL1 1419/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ESR2 4381/4885ESR1 3527/4885MCL1 3415/4885

“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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