SCHEMBL18308753

SCHEMBL18308753

Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2C)ccc1P

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 3/20 0.38
▸ ESR1 P03372 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ HSD17B1 P14061 2/20 0.32
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ HSD17B2 P37059 1/20 0.31
▸ FGFR1 P11362 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ SLC2A1 P11166 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
SCHEMBL18308759 0.90 ALDH1A1 (0.41) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308730 0.90 ALDH1A1 (0.41) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308769 0.89 ESR2 (0.38) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308742 0.88 ESR2 (0.41) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308767 0.86 ESR2 (0.39) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308752 0.83 ALDH1A1 (0.46) ESR2ALDH1A1CYP3A4TSHRTDP1
SCHEMBL18308786 0.82 ESR2 (0.37) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308763 0.82 ESR2 (0.37) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308751 0.82 ESR1 (0.34) ESR2ESR1ALDH1A1CYP3A4TSHR
SCHEMBL18308738 0.81 ALDH1A1 (0.48) 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 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 2744/4885ALDH1A1 4572/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C ESR2 4322/4885ESR1 2626/4885ALDH1A1 4590/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 ESR2 4381/4885ESR1 3527/4885ALDH1A1 4429/4885

“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