SCHEMBL22019447

SCHEMBL22019447

C=Cc1c(CC)c[nH]c1C

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 2/20 0.31
PDXK O00764 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL20718427 0.83
SCHEMBL13069656 0.79 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL27304114 0.75 CNR1 (0.32)
SCHEMBL3626333 0.73 DPYD (0.39)
SCHEMBL21133443 0.72
SCHEMBL6060895 0.72
SCHEMBL7173883 0.70 SMN1; SMN2 (0.34) SMN1; SMN2MAPTKMT2AHSD17B10NPC1
SCHEMBL26781364 0.70
SCHEMBL26063169 0.68
SCHEMBL12249888 0.67 SMN1; SMN2 (0.33) SMN1; SMN2MAPTKMT2AHSD17B10NPC1

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
WO-2020099925-A2 PEPTIDES AND PHARMACEUTICAL COMPOSITIONS FOR TREATING EYE DISEASES YUYU PHARMA, INC. (KR) 2020-05-22 WO disclosed