SCHEMBL21165795

SCHEMBL21165795

CCOc1ccc(C#Cc2ccc(C3CCCCC3)cc2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.36
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
APOBEC3G Q9HC16 2/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
ADK P55263 1/20 0.33
PAX8 Q06710 4/20 0.32
S1PR1 P21453 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32

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
SCHEMBL9511367 0.89 ESR2 (0.37) KDM1AHRH3ALDH1A1MEN1KMT2A
SCHEMBL21165799 0.89 ESR2 (0.37) KDM1AHRH3ALDH1A1MEN1KMT2A
SCHEMBL9509015 0.88 ACACB (0.38) KDM1A
SCHEMBL21165797 0.86 CYP2C9 (0.41) KDM1AALDH1A1LMNAMAPTMEN1
SCHEMBL7908845 0.86 CYP2C9 (0.41) KDM1AALDH1A1LMNAMAPTMEN1
SCHEMBL9510166 0.84 CYP2C9 (0.34) KDM1AHRH3ALDH1A1HPGDTSHR
SCHEMBL7771529 0.84 KDM1A (0.32) KDM1A
SCHEMBL7910615 0.83 CYP2C9 (0.34) KDM1AALDH1A1LMNAMAPTMEN1
SCHEMBL9509441 0.82 SPHK1 (0.34) KDM1AALDH1A1LMNAMAPTMEN1
SCHEMBL9509049 0.82 SPHK1 (0.34) KDM1AALDH1A1LMNAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190219856-A1 LIQUID CRYSTAL PANEL, SWITCHABLE MIRROR PANEL AND SWITCHABLE MIRROR DISPLAY SHARP KABUSHIKI KAISHA (JP) 2019-07-18 US disclosed