SCHEMBL6667419

SCHEMBL6667419

CC(=O)C1(Cc2ccccc2)C=CC=CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALDH1A1 P00352 4/20 0.36
LMNA P02545 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PTPN7 P35236 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL20377192 0.87 HSD11B1 (0.39) HSD11B1CYP3A4ALDH1A1LMNAMEN1
SCHEMBL29290551 0.79 EPHX2 (0.41) CYP3A4ALDH1A1MEN1KMT2ATDP1
SCHEMBL29060724 0.78 MAOA (0.33) HSD11B1ALDH1A1MAOAMAOB
SCHEMBL30128591 0.75 HSD11B1 (0.41) HSD11B1ALDH1A1MEN1KMT2AMAPT
SCHEMBL28244218 0.75
SCHEMBL5614141 0.74
SCHEMBL11582266 0.73
SCHEMBL8155755 0.71 MAOA (0.38) HSD11B1OPRM1OPRL1MAOAMAOB
SCHEMBL1131345 0.70 MAPK1 (0.35) CYP3A4
SCHEMBL7894379 0.70 MAOA (0.37) HSD11B1ALDH1A1LMNAMEN1KMT2A

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-2004013407-A2 USE OF FLAVYLIUM COMPOUND DERIVATIVES TO BE FIXED TO SOLID SUBSTRATES, FIXING COMPOSITIONS USED, AND RESULTING SUBSTRATES UNIVERSITE LOUIS PASTEUR (FR) 2004-02-12 WO disclosed