SCHEMBL18084151

SCHEMBL18084151

CC/C(=C/O)c1ccccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.40
F2R P25116 1/20 0.40
ALDH1A1 P00352 5/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MAPK1 P28482 2/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL18508975 0.85 HPGD (0.41) HPGDF2RALDH1A1KMT2ANPC1
SCHEMBL27427796 0.82 MAOA (0.41) HPGDF2RALDH1A1KMT2ANPC1
SCHEMBL17265664 0.82 HPGD (0.39) HPGDF2RALDH1A1KMT2ANPC1
SCHEMBL14887456 0.82 MAOA (0.41) HPGDALDH1A1KMT2ANPC1RAB9A
SCHEMBL7947843 0.77 HPGD (0.47) HPGDALDH1A1KMT2ANPC1RAB9A
SCHEMBL2119445 0.73 ERCC5 (0.44) HPGDKMT2AERCC5FEN1SMN1; SMN2
SCHEMBL5011123 0.73 ERCC5 (0.44) HPGDALDH1A1KMT2AERCC5FEN1
SCHEMBL13957399 0.72 HPGD (0.41) HPGDALDH1A1KMT2AL3MBTL1ERCC5
SCHEMBL24832677 0.71 HPGD (0.44) HPGDALDH1A1KMT2AERCC5FEN1
SCHEMBL16257948 0.71 TSHR (0.41) HPGDERCC5FEN1SMN1; SMN2MAOA

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-9434761-B2 Tripeptide epoxy ketone protease inhibitors ONYX THERAPEUTICS, INC. (US) 2016-09-06 US disclosed