SCHEMBL7543410

SCHEMBL7543410

CCc1ccc(C(c2ccc(CC)c(N)c2)(C(F)(F)F)C(F)(F)F)cc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.38
ESR2 Q92731 4/20 0.38
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CFTR P13569 1/20 0.37
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
AR P10275 2/20 0.36
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.36
PKM P14618 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL15325793 0.85 ALDH1A1 (0.37) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL28230962 0.85 ESR1 (0.38) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL14367955 0.84 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDHSD17B10CFTR
SCHEMBL11932057 0.82 ALDH1A1 (0.38) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL12367664 0.79 ESR1 (0.46) ESR1ESR2ALDH1A1HPGDHSD17B10
SCHEMBL15747030 0.78 DAO (0.36) ESR1ESR2MAPTARHSD11B1
SCHEMBL9505783 0.78 ALDH1A1 (0.55) ESR1ESR2ALDH1A1HPGDHSD17B10
SCHEMBL296596 0.77 ESR1 (0.44) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL29540299 0.77 ESR1 (0.44) ESR1ESR2ALDH1A1KDM4EHPGD
SCHEMBL26417533 0.76 MEN1 (0.37) ALDH1A1KDM4EHSD17B10CFTRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0725284-B1 Ocular lens material MENICON CO LTD (JP) 2002-05-22 EP disclosed
EP-0634673-B1 Ocular lens material MENICON CO LTD (JP) 1999-10-20 EP disclosed
US-5703143-A SILICON-CONTAINING POLYPHENYLENE ETHER POLYMER MENICON CO., LTD. (JP) 1997-12-30 US disclosed
US-5605942-A POLYIMIDE HAVING EXCELLENT TRANSPARENCY, OXYGEN PERMEABILITY, HEAT RESISTANCE, ULTRAVIOLET LIGHT ABSORPTION MENICON CO., LTD. (JP) 1997-02-25 US disclosed
EP-0725284-A2 Ocular lens material Menicon Co., Ltd. (JP) 1996-08-07 EP disclosed
US-5543442-A POLYIMIDESILOXANE COPOLYMER MENICON CO., LTD. (JP) 1996-08-06 US disclosed
EP-0634673-A1 Ocular lens material Menicon Co., Ltd. (JP) 1995-01-18 EP disclosed