SCHEMBL22872139

SCHEMBL22872139

CCCc1ccc(-c2ccc(-c3ccc(C(F)(F)F)s3)c(F)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.40
▸ RARA P10276 1/20 0.40
▸ RARG P13631 1/20 0.40
▸ MAOB P27338 2/20 0.38
▸ KIF11 P52732 1/20 0.38
▸ PDK2 Q15119 1/20 0.36
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ QPCT Q16769 1/20 0.35
▸ GRIN1 Q05586 1/20 0.34
▸ GRIN2B Q13224 1/20 0.34
▸ KIFC1 Q9BW19 2/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ S1PR1 P21453 3/20 0.34
▸ S1PR3 Q99500 2/20 0.34
▸ ALOX5 P09917 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
SCHEMBL22872133 0.85 RARB (0.39) RARBRARARARGMAOBKIF11
SCHEMBL1533754 0.85 RARB (0.40) RARBRARARARGMAOBTAAR1
SCHEMBL22872138 0.84 HSD11B1 (0.38) RARBPDK2PDE3BPDE3AGRIN1
SCHEMBL1533774 0.84 RARB (0.39) RARBRARARARGMAOBTAAR1
SCHEMBL1533777 0.84 RARB (0.39) RARBRARARARGTAAR1MCL1
SCHEMBL22872125 0.83 ESR1 (0.40) KIF11PDK2PDE3BPDE3AQPCT
SCHEMBL1533776 0.83 RARB (0.42) RARBRARARARGMCL1ESR1
SCHEMBL1533784 0.83 RARB (0.39) RARBRARARARGMAOBTAAR1
SCHEMBL1533783 0.82 RARB (0.47) RARBRARARARGMCL1ESR1
SCHEMBL22872137 0.81 PTPN1 (0.38) MAOBGRIN1GRIN2BHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4279565-A2 THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2023-11-22 — — EP disclosed
EP-3763802-B1 THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2023-09-06 — — EP disclosed
EP-4015599-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2022-06-22 — — EP disclosed
US-11359142-B2 Liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2022-06-14 — — US disclosed
US-11168255-B2 Thiophene compound, liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2021-11-09 — — US disclosed
US-20210189241-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2021-06-24 — — US disclosed
EP-3839009-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2021-06-23 — — EP disclosed
EP-3763802-A1 THIOPHENE COMPOUND, LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME Merck Patent GmbH (DE) 2021-01-13 — — EP disclosed
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