SCHEMBL20160874

SCHEMBL20160874

N#Cc1ccc(-c2ccc(-c3ccc(CN)cc3)cc2F)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.58
NSD2 O96028 6/20 0.53
KIF11 P52732 1/20 0.49
TAAR1 Q96RJ0 3/20 0.46
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
RORC P51449 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM1A O60341 1/20 0.39

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
SCHEMBL397141 0.87 KIF11 (0.61) NSD2KIF11PDE3BPDE3ARORC
SCHEMBL17946137 0.85 CYP2A6 (0.58) NSD2KIF11PDE3BPDE3ARORC
SCHEMBL9406878 0.82 TSHR (0.54) NSD2KIF11PDE3BPDE3ARORC
SCHEMBL29637013 0.82 TSHR (0.54) NSD2KIF11PDE3BPDE3ARORC
SCHEMBL7913848 0.82 TSHR (0.54) NSD2KIF11PDE3BPDE3ARORC
SCHEMBL15245752 0.82 LOXL2 (0.86) LOXL2NSD2KIF11TAAR1HRH3
SCHEMBL15834358 0.81 KIF11 (0.54) KIF11PDE3BPDE3ARORCKDM1A
SCHEMBL18800279 0.81 LOXL2 (0.52) LOXL2KIF11TAAR1PDE3BPDE3A
SCHEMBL19824581 0.81 TAAR1 (0.62) LOXL2TAAR1HRH3
SCHEMBL19308493 0.81 KIF11 (0.54) KIF11PDE3BPDE3ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11174431-B2 Liquid crystal composition and liquid crystal display device DIC CORPORATION (JP) 2021-11-16 US disclosed
US-10975304-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2021-04-13 US disclosed
US-10913895-B2 Liquid crystal composition and liquid crystal display device DIC CORPORATION (JP) 2021-02-09 US disclosed
US-10913896-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2021-02-09 US disclosed
US-10752838-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2020-08-25 US disclosed
US-20180171229-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180171234-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180134961-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-05-17 US disclosed