SCHEMBL22872113

SCHEMBL22872113

Oc1ccc(-c2ccc(OC(F)(F)F)s2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 11/20 0.37
▸ HSD17B2 P37059 11/20 0.37
▸ STS P08842 6/20 0.37
▸ AR P10275 1/20 0.31
▸ SNCA P37840 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
SCHEMBL22872118 0.81 ESR2 (0.33) —
SCHEMBL23996080 0.79 APP (0.37) HSD17B1HSD17B2STS
SCHEMBL22872135 0.76 DAO (0.37) HSD17B1HSD17B2STSARSNCA
SCHEMBL18133449 0.68 MPL (0.35) AR
SCHEMBL23552167 0.68 ESR1 (0.41) HSD17B1HSD17B2
SCHEMBL22872112 0.67 ESR1 (0.38) HSD17B1HSD17B2AR
SCHEMBL4451075 0.66 AR (0.46) AR
SCHEMBL5541865 0.65 — —
SCHEMBL17365885 0.65 EPHX2 (0.43) HSD17B1HSD17B2STS
SCHEMBL22872111 0.64 APP (0.37) HSD17B1HSD17B2

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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