SCHEMBL18308778

SCHEMBL18308778

Cc1cc(CP)ccc1-c1cccc(-c2ccc(P)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 2/20 0.36
▸ ESR2 Q92731 2/20 0.34
▸ TAAR1 Q96RJ0 4/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ ESR1 P03372 2/20 0.33
▸ HSD17B1 P14061 1/20 0.33
▸ HSD17B2 P37059 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH2 P05091 1/20 0.32
▸ MAOB P27338 3/20 0.32
▸ RORC P51449 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32

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
SCHEMBL18308810 0.92 HTR7 (0.35) HTR7ESR2TAAR1FFAR1PGR
SCHEMBL18308785 0.90 HTR7 (0.37) HTR7ESR2FFAR1ESR1ALDH2
SCHEMBL18308757 0.90 RARB (0.35) ESR2ESR1HSD17B1RORC
SCHEMBL18308735 0.89 RARB (0.36) ESR2ESR1HSD17B1RORC
SCHEMBL18308797 0.86 HTR7 (0.35) HTR7ESR2FFAR1ESR1HSD17B1
SCHEMBL18308748 0.85 RARB (0.35) ESR2ESR1HSD17B1RORC
SCHEMBL18308762 0.85 RARB (0.35) ESR2ESR1HSD17B1RORC
SCHEMBL18308804 0.84 HTR7 (0.36) HTR7ESR2TAAR1FFAR1ESR1
SCHEMBL18308805 0.84 HTR7 (0.41) HTR7ESR2FFAR1ESR1ALDH2
SCHEMBL18621860 0.84 PTGER4 (0.36) TAAR1ESR1HSD17B1HSD17B2MEN1

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 4 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
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 HTR7 4174/4885ESR2 4146/4885TAAR1 3749/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C HTR7 3960/4885ESR2 4322/4885TAAR1 3404/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 HTR7 4122/4885ESR2 4381/4885TAAR1 3256/4885

“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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