SCHEMBL6479818

SCHEMBL6479818

COc1ccc(C2(c3ccc(N4CCCC4)cc3)C=Cc3c(C)cc4c(F)cc(OC)cc4c3O2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.38
TDP1 Q9NUW8 3/20 0.38
MAPK1 P28482 2/20 0.38
KDM4E B2RXH2 6/20 0.33
ALDH1A1 P00352 5/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
RECQL P46063 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 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
SCHEMBL6492241 0.88 ALDH1A1 (0.37) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL12659492 0.83 MAPT (0.35) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL6480463 0.82 MAPT (0.35) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL10102269 0.81 MAPT (0.36) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL7533658 0.78 PIK3CA (0.37) MAPTMAPK1KDM4EALDH1A1HPGD
SCHEMBL7528995 0.78 ALDH1A1 (0.37) KDM4EALDH1A1HPGDKMT2AL3MBTL1
SCHEMBL10106931 0.76 MAPT (0.39) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL6479062 0.76 ALDH1A1 (0.34) MAPTTDP1MAPK1KDM4EALDH1A1
SCHEMBL10102406 0.73 SLC2A1 (0.36) MAPTKDM4EALDH1A1HPGDKMT2A
SCHEMBL7528300 0.73 PKM (0.37) MAPTMAPK1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6863843-B2 Naphthopyran compounds, photoresponsive compositions and lenses VISION-EASE LENS, INC. (US) 2005-03-08 US disclosed
US-20020080451-A1 Novel naphthopyran compounds, photoresponsive compositions and lenses VISION-EASE LENS, INC. 2002-06-27 US disclosed