SCHEMBL19119878

SCHEMBL19119878

CCCCOc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(CCC(CC)CCCC)cc5F)s4)c4nsnc34)c(F)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RARA P10276 1/20 0.36
▸ RARB P10826 1/20 0.36
▸ S1PR1 P21453 2/20 0.33
▸ S1PR3 Q99500 2/20 0.33
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ CYP2D6 P10635 2/20 0.31
▸ CYP1A2 P05177 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
SCHEMBL20900687 0.97 RARA (0.37) RARARARBS1PR1S1PR3LMNA
SCHEMBL20975633 0.94 RARA (0.35) RARARARBS1PR1S1PR3LMNA
SCHEMBL19636762 0.91 RARA (0.36) RARARARBS1PR1S1PR3LMNA
SCHEMBL18418560 0.90 S1PR1 (0.38) RARARARBS1PR1S1PR3LMNA
SCHEMBL19119902 0.89 RARA (0.36) RARARARBS1PR1S1PR3LMNA
SCHEMBL21608685 0.89 ESR1 (0.31) —
SCHEMBL20975632 0.88 RARA (0.35) RARARARBS1PR1S1PR3LMNA
SCHEMBL16265269 0.88 ESR1 (0.32) —
SCHEMBL18418546 0.87 RARA (0.37) RARARARBS1PR1S1PR3LMNA
SCHEMBL19119557 0.87 RARA (0.35) RARARARBLMNAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230053362-A1 DICHROIC DYE COMPOSITION MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
US-11015123-B2 Liquid-crystal material MERCK PATENT GMBH (DE) 2021-05-25 — — US disclosed
US-20200255741-A1 LIQUID-CRYSTAL MATERIAL MERCK PATENT GMBH (DE) 2020-08-13 — — US disclosed
US-10723950-B2 Liquid-crystalline mixtures MERCK PATENT GMBH (DE) 2020-07-28 — — US disclosed
US-10711138-B2 Intermediates and procedures for the synthesis of functional materials MERCK PATENT GMBH (DE) 2020-07-14 — — US disclosed
US-20190127586-A1 INTERMEDIATES AND PROCEDURES FOR THE SYNTHESIS OF FUNCTIONAL MATERIALS MERCK PATENT GMBH (DE) 2019-05-02 — — US disclosed
US-20190016955-A1 LIQUID-CRYSTALLINE MIXTURES MERCK PATENT GMBH (DE) 2019-01-17 — — US disclosed
WO-2017198637-A1 LIQUID-CRYSTAL MATERIAL MERCK PATENT GMBH (DE) 2017-11-23 — — WO disclosed
WO-2017174619-A1 INTERMEDIATES AND PROCEDURES FOR THE SYNTHESIS OF FUNCTIONAL MATERIALS MERCK PATENT GMBH (DE) 2017-10-12 — — WO disclosed
WO-2017118464-A1 LIQUID-CRYSTALLINE MIXTURES MERCK PATENT GMBH (DE) 2017-07-13 — — WO disclosed
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