SCHEMBL3685809

SCHEMBL3685809

Oc1ccc(C(c2ccc(O)cc2)(C(F)F)C(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.54
ESR2 Q92731 10/20 0.54
KIF11 P52732 1/20 0.46
CYP3A4 P08684 3/20 0.41
LMNA P02545 2/20 0.41
TYR P14679 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
AR P10275 1/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41
ESRRG P62508 1/20 0.41
SLC6A3 Q01959 1/20 0.41
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 1/20 0.36

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
SCHEMBL3515333 0.83 ESR1 (0.45) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL6130606 0.78 ESR1 (0.48) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL25590621 0.77 KIF11 (0.46) KIF11CYP3A4LMNAHPGDTSHR
SCHEMBL1719753 0.77 ESR1 (0.54) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL27620452 0.76 ESR1 (0.52) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL28512548 0.76 ESR1 (0.52) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL14205568 0.75 SRD5A2 (0.53) TYRHPGDHSD17B10TSHRALDH1A1
SCHEMBL27878898 0.74 ESR1 (0.50) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL320071 0.73 ESR1 (0.48) ESR1ESR2KIF11CYP3A4LMNA
SCHEMBL11052001 0.73 ESR1 (0.48) ESR1ESR2KIF11CYP3A4LMNA

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-7700714-B2 Optical element and achromatic lens TEIJIN CHEMICALS, LTD. (JP) 2010-04-20 US disclosed
US-20090143560-A1 Optical Element and Achromatic Lens TEIJIN CHEMICALS, LTD. 2009-06-04 US disclosed
EP-1947131-A1 OPTICAL DEVICE AND ACHROMATIC LENS Teijin Chemicals, Ltd. (JP) 2008-07-23 EP disclosed