SCHEMBL3205762

SCHEMBL3205762

C(=Cc1ccccc1)C1=CCC(C=Cc2ccccc2)(C=Cc2ccccc2)C=C1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHAT P28329 2/20 0.34
NFE2L2 Q16236 4/20 0.33
MAOB P27338 3/20 0.33
CYP19A1 P11511 2/20 0.33
MAOA P21397 2/20 0.33
TTR P02766 1/20 0.33
ALOX5 P09917 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RELA Q04206 2/20 0.31
TRPA1 O75762 2/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
GLA P06280 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3413571 0.80 MAOB (0.33) CHATMAOBGLATDP1
SCHEMBL3281981 0.80 CHAT (0.32) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL3281982 0.80 CHAT (0.32) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL4438933 0.79 MAOB (0.39) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL6837817 0.78 CHAT (0.35) CHATNFE2L2MAOBCYP19A1MAOA
Hydrochloric Acid SCHEMBL12003783 0.78 MAOB (0.38) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL31506486 0.78 CHAT (0.35) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL28697334 0.78 CHAT (0.35) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL4595773 0.78 CHAT (0.39) CHATNFE2L2MAOBCYP19A1MAOA
SCHEMBL28484538 0.78 CHAT (0.39) CHATNFE2L2MAOBCYP19A1MAOA

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-20100040978-A1 PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2010-02-18 US disclosed