SCHEMBL20005231

SCHEMBL20005231

Cc1ccc(-c2ccc(C#Cc3cc(F)c(-c4cc(F)c(F)c(F)c4)cc3C)cc2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.34
KDM1A O60341 1/20 0.33
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
RPS6KA3 P51812 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
SCHEMBL20005213 0.99 FFAR1 (0.33) FFAR1KDM1APDE3BPDE3ARPS6KA3
SCHEMBL20005240 0.99 FFAR1 (0.33) FFAR1KDM1APDE3BPDE3ARPS6KA3
SCHEMBL20006703 0.94 PDE3B (0.33) FFAR1PDE3BPDE3ARPS6KA3
SCHEMBL20006719 0.94 PDE3B (0.33) FFAR1PDE3BPDE3ARPS6KA3
SCHEMBL20005292 0.87 AKR1C3 (0.32) KDM1APDE3BPDE3A
SCHEMBL19258829 0.84 CYP11B1 (0.33) FFAR1PDE3BPDE3ARPS6KA3
SCHEMBL19999642 0.84 AKR1C3 (0.30)
SCHEMBL19999512 0.84 AKR1C3 (0.30)
SCHEMBL20005287 0.84 ESR1 (0.38) FFAR1KDM1APDE3BPDE3A
SCHEMBL2741544 0.83 GRM5 (0.36) FFAR1KDM1APDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed
EP-3299439-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2018-03-28 EP disclosed