SCHEMBL22872138

SCHEMBL22872138

CCCc1ccc(-c2ccc(-c3ccc(C(F)(F)F)s3)c(F)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.38
▸ GRIN1 Q05586 2/20 0.35
▸ GRIN2B Q13224 2/20 0.35
▸ PDK2 Q15119 1/20 0.35
▸ RARB P10826 1/20 0.34
▸ PDE3B Q13370 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ MPL P40238 4/20 0.34
▸ TRPV3 Q8NET8 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ FAAH O00519 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ MMP2 P08253 1/20 0.31

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
SCHEMBL22872139 0.84 RARB (0.40) HSD11B1GRIN1GRIN2BPDK2RARB
SCHEMBL22872137 0.84 PTPN1 (0.38) HSD11B1GRIN1GRIN2BMAPTRAB9A
SCHEMBL22872123 0.82 PDE3B (0.37) GRIN1GRIN2BPDK2PDE3BPDE3A
SCHEMBL9494063 0.80 LPL (0.42) RARBMPLMAPTRAB9ANPC1
SCHEMBL24300663 0.78 FFAR4 (0.40) RARBMPLMAPTRAB9ANPC1
SCHEMBL9563689 0.78 MCL1 (0.41) RARBMPLMAPTRAB9ANPC1
SCHEMBL24300666 0.77 MAOA (0.36) MPL
SCHEMBL9493130 0.77 MPL (0.48) HSD11B1RARBMPLALDH1A1
SCHEMBL14371089 0.77 HSD11B1 (0.46) HSD11B1PDK2RARBMPLMAPT
SCHEMBL22872133 0.77 RARB (0.39) HSD11B1GRIN1GRIN2BPDK2RARB

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
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
US-11168255-B2 Thiophene compound, liquid-crystalline medium and liquid-crystal display comprising the same MERCK PATENT GMBH (DE) 2021-11-09 — — US 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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