SCHEMBL19720358

SCHEMBL19720358

Fc1ccc(-c2ccc(CCC3CCCCC3)cc2)cc1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
PGR P06401 3/20 0.40
GPR84 Q9NQS5 1/20 0.39
AAK1 Q2M2I8 1/20 0.39
DAO P14920 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
BRS3 P32247 2/20 0.38
MAOB P27338 2/20 0.38
TAAR1 Q96RJ0 1/20 0.37
CTSD P07339 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL8768381 0.90 CYP17A1 (0.41) CYP17A1CYP11B1CYP11B2PGRGPR84
SCHEMBL8768373 0.90 CYP17A1 (0.41) CYP17A1CYP11B1CYP11B2PGRGPR84
SCHEMBL8767034 0.88 CYP17A1 (0.42) CYP17A1CYP11B1CYP11B2PGRTAAR1
SCHEMBL19720332 0.88 GPR84 (0.39) GPR84AAK1DAOBRS3MAOB
SCHEMBL16191333 0.87 ALDH1A1 (0.46) DAOALDH1A1HTTMAOB
SCHEMBL8767558 0.87 RARB (0.43) CYP17A1CYP11B1CYP11B2PGRGPR84
SCHEMBL19720372 0.85 RORC (0.38) PGRDAOALDH1A1HTTBRS3
SCHEMBL14064240 0.85 GPR84 (0.43) CYP17A1CYP11B1CYP11B2PGRGPR84
SCHEMBL21592063 0.85 HRH3 (0.42) CYP17A1CYP11B1CYP11B2PGRGPR84
SCHEMBL10345128 0.85 CYP17A1 (0.42) CYP17A1CYP11B1CYP11B2PGRGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023094404-A1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2023-06-01 WO disclosed
US-20220119711-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2022-04-21 US disclosed
EP-3985085-A2 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2022-04-20 EP disclosed
EP-3666853-B1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2021-06-16 EP disclosed
EP-3666853-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2020-06-17 EP disclosed
EP-3327102-B1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2020-04-15 EP disclosed
EP-3327102-A1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY Merck Patent GmbH (DE) 2018-05-30 EP disclosed
EP-3275973-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2018-01-31 EP disclosed
EP-2855630-B1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2017-12-20 EP disclosed