SCHEMBL8724020

SCHEMBL8724020

COc1ccc(C2(c3cc4ccccc4o3)C=Cc3c(cc(OC(C)=O)c4ccccc34)O2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
TDP1 Q9NUW8 2/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 4/20 0.37
MAOB P27338 2/20 0.37
ACHE P22303 1/20 0.37
TP53 P04637 3/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CD74 P04233 1/20 0.36
MIF P14174 1/20 0.36
MEN1 O00255 3/20 0.34
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL8445339 0.88 BACE1 (0.40) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL8722690 0.79 HTT (0.43) MAPTTDP1NPC1RAB9AKDM4E
SCHEMBL7553115 0.76 PDE4D (0.39) MAPTTDP1KDM4EALDH1A1KMT2A
SCHEMBL8782636 0.73 GPR84 (0.39) MAPTTDP1CASP3SENP7NPC1
SCHEMBL9257841 0.72 KDM4E (0.41) MAPTTDP1NPC1KDM4EALDH1A1
SCHEMBL5094598 0.72 HTT (0.37) MAPTTDP1KDM4EALDH1A1KMT2A
SCHEMBL8727667 0.72 GABRA1 (0.34) MAPTTDP1NPC1RAB9AKDM4E
SCHEMBL8311131 0.71 EP300 (0.35) MAPTCASP3SENP7NPC1RAB9A
SCHEMBL5615531 0.71 ALDH1A1 (0.43) MAPTTDP1NPC1RAB9AKDM4E
SCHEMBL5615321 0.69 SMN1; SMN2 (0.43) MAPTTDP1NPC1RAB9AKDM4E

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-5744070-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1998-04-28 US claimed
US-5744070-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1998-04-28 US disclosed