SCHEMBL23552202

SCHEMBL23552202

Cc1ccc(-c2cc(F)c(-c3ccc(OC(F)(F)F)s3)c(F)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ HSD17B1 P14061 2/20 0.31
▸ HSD17B2 P37059 2/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ MMP12 P39900 1/20 0.30
▸ ALOX5AP P20292 1/20 0.30
▸ FEN1 P39748 1/20 0.30
▸ AR P10275 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
SCHEMBL22872112 0.85 ESR1 (0.38) CYP11B1CYP11B2HSD17B1HSD17B2PTGS2
SCHEMBL22872111 0.82 APP (0.37) HSD17B1HSD17B2FEN1
SCHEMBL22872114 0.78 CYP11B1 (0.37) CYP11B1CYP11B2HSD17B1HSD17B2AR
SCHEMBL2741568 0.77 PTGS2 (0.38) CYP11B1CYP11B2HSD17B1HSD17B2PTGS2
SCHEMBL22872120 0.77 HSD17B1 (0.33) CYP11B1CYP11B2HSD17B1HSD17B2PTGS2
SCHEMBL27027789 0.76 MAOB (0.34) PTGS2ALOX5APFEN1
SCHEMBL12889451 0.74 CYP11B1 (0.39) CYP11B1CYP11B2PTGS2MMP12ALOX5AP
SCHEMBL24301043 0.74 KDM1A (0.36) PTGS2
SCHEMBL17210772 0.74 PDE2A (0.41) CYP11B1CYP11B2ALOX5APFEN1
SCHEMBL23552167 0.72 ESR1 (0.41) HSD17B1HSD17B2ALOX5APFEN1

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
WO-2024126567-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2024-06-20 — — WO disclosed
EP-4306614-A1 LIQUID-CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2024-01-17 — — EP disclosed
WO-2023198673-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-19 — — WO disclosed
WO-2023198671-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-19 — — WO disclosed
WO-2023198669-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-19 — — WO disclosed
EP-4261269-A1 LIQUID-CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2023-10-18 — — EP disclosed
US-20230323207-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-12 — — US disclosed
US-20230323207-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2023-10-12 — — US disclosed
US-11359142-B2 Liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2022-06-14 — — US disclosed
US-20210189241-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME MERCK PATENT GMBH (DE) 2021-06-24 — — US disclosed
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