SCHEMBL7836075

SCHEMBL7836075

CCc1c(Sc2cc(C)cc(C)c2)[nH]c(=O)n(Cc2nc3ccccc3o2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
AKR1B1 P15121 1/20 0.37
PIK3CB P42338 2/20 0.36
PIK3CD O00329 1/20 0.36
DPP4 P27487 1/20 0.35
CNR2 P34972 1/20 0.35
HCRTR2 O43614 1/20 0.35
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
ADORA2B P29275 1/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 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
SCHEMBL7837569 0.86 KMT2A (0.37) RAB9AKMT2AMEN1AKR1B1PIK3CB
SCHEMBL6089793 0.85 RAB9A (0.38) RAB9AKMT2AMEN1AKR1B1PIK3CB
SCHEMBL7848837 0.81 TP53 (0.39) RAB9AKMT2AMEN1AKR1B1PIK3CB
SCHEMBL8183668 0.81 ALDH1A1 (0.42) KMT2AMEN1MAPTTP53ALDH1A1
SCHEMBL7849246 0.80 TP53 (0.41) RAB9AKMT2AMEN1AKR1B1PIK3CB
SCHEMBL7846972 0.78 CYP1A2 (0.34) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL7845277 0.77 GRIN1 (0.45) GABRA1GABRA5ALDH1A1KDM4EHPGD
SCHEMBL6086306 0.77 KMT2A (0.39) RAB9AKMT2AMEN1AKR1B1PIK3CB
SCHEMBL7848188 0.76 TLR7 (0.33) RAB9AKMT2AMEN1MAPTNPC1
SCHEMBL6087657 0.76 TP53 (0.39) RAB9AKMT2AMEN1PIK3CBPIK3CD

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
EP-1100786-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-05-23 EP disclosed
WO-2000061564-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed