SCHEMBL16488491

SCHEMBL16488491

C=CCCc1ccc(-c2ccc(-c3cc(F)c(-c4cc(F)c(F)c(F)c4)c(F)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
CYP17A1 P05093 2/20 0.33
CYP11B1 P15538 2/20 0.33
CYP21A2 P08686 1/20 0.33
RARB P10826 2/20 0.31
RARA P10276 1/20 0.31
RARG P13631 1/20 0.31
CYP11B2 P19099 1/20 0.31
KIF11 P52732 1/20 0.30
ANPEP P15144 2/20 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
SCHEMBL8578398 0.94 MAOB (0.39) MAOBTAAR1CYP17A1CYP11B1CYP21A2
SCHEMBL8424786 0.94 MAOB (0.39) MAOBTAAR1CYP17A1CYP11B1CYP21A2
SCHEMBL13002324 0.88 KIF11 (0.38) MAOBTAAR1CYP17A1CYP11B1CYP21A2
SCHEMBL3158395 0.87 ESR1 (0.35)
SCHEMBL8403874 0.85 FFAR1 (0.35) MAOBTAAR1CYP17A1CYP11B1CYP21A2
SCHEMBL18193783 0.84 ALDH1A1 (0.37) CYP17A1CYP11B1CYP11B2KIF11ANPEP
SCHEMBL13412036 0.83 TAAR1 (0.36) MAOBTAAR1CYP17A1CYP11B1RARB
SCHEMBL13239275 0.83 TAAR1 (0.36) MAOBTAAR1CYP17A1CYP11B1RARB
SCHEMBL3262256 0.82 ESR1 (0.37) TAAR1CYP17A1CYP11B1CYP21A2CYP11B2
SCHEMBL16488493 0.82 MAOB (0.33) MAOBTAAR1CYP17A1CYP11B1CYP21A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2837670-B1 FLUOROBIPHENYL-CONTAINING COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2017-09-27 EP disclosed
US-9441160-B2 Fluorobiphenyl-containing composition DIC CORPORATION (JP) 2016-09-13 US disclosed
US-9441160-B2 Fluorobiphenyl-containing composition DIC CORPORATION (JP) 2016-09-13 US disclosed
US-9181478-B2 Fluorobiphenyl-containing composition DIC CORPORATION (JP) 2015-11-10 US disclosed
US-9181478-B2 Fluorobiphenyl-containing composition DIC CORPORATION (JP) 2015-11-10 US disclosed
US-20150291881-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-10-15 US disclosed
US-20150291881-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-10-15 US disclosed
US-20150252263-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-09-10 US disclosed
US-20150252263-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-09-10 US disclosed
US-20150053891-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-02-26 US disclosed
US-20150053891-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC CORPORATION (JP) 2015-02-26 US disclosed
EP-2837670-A1 FLUOROBIPHENYL-CONTAINING COMPOSITION DIC Corporation (JP) 2015-02-18 EP disclosed