SCHEMBL18308799

SCHEMBL18308799

Cc1ccc(-c2cc(C)cc(-c3ccc(P)cc3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.42
▸ RXRB P28702 2/20 0.42
▸ ACHE P22303 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ MCL1 Q07820 1/20 0.34
▸ NPC1 O15118 3/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ AKR1C2 P52895 1/20 0.34
▸ AKR1C1 Q04828 1/20 0.34
▸ HPRT1 P00492 1/20 0.34
▸ RCE1 Q9Y256 1/20 0.34
▸ CNR2 P34972 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
SCHEMBL20382350 0.95 RXRA (0.45) RXRARXRBDHODHESR1CNR2
SCHEMBL26173346 0.93 RXRA (0.48) RXRARXRBACHEESR1CNR2
SCHEMBL26173308 0.90 RXRA (0.50) RXRARXRBACHETDP1ESR1
SCHEMBL25951281 0.87 ACHE (0.50) RXRARXRBACHETDP1CA1
SCHEMBL12991138 0.87 ACHE (0.50) ACHETDP1CA1CA2CA7
SCHEMBL1687651 0.87 ACHE (0.50) ACHETDP1CA1CA2CA7
SCHEMBL18621840 0.85 RXRA (0.42) RXRARXRBACHEMEN1KMT2A
SCHEMBL18621839 0.84 DHODH (0.45) TDP1CA2CA9MEN1KMT2A
SCHEMBL18308813 0.83 RXRA (0.37) RXRARXRBTDP1CA9ESR1
SCHEMBL1046627 0.82 RXRA (0.56) RXRARXRBACHETDP1CA1

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 RXRA 2691/4885RXRB 3380/4885ACHE 2422/4885
US-20170121606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, LCP1, MAP1LC3C RXRA 1974/4885RXRB 2761/4885ACHE 3360/4885
US-20160362606-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS VCL, PLEC, EML4 RXRA 2009/4885RXRB 2698/4885ACHE 3377/4885

“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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