SCHEMBL6922985

SCHEMBL6922985

Nn1c(C2CCOCC2)cc(-c2ccccc2)cc1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
GLO1 Q04760 2/20 0.36
HSP90AA1 P07900 1/20 0.36
PRKDC P78527 7/20 0.35
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
MAPK3 P27361 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 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
SCHEMBL6924508 0.90 L3MBTL1 (0.57) L3MBTL1GLO1HSP90AA1GABRA1GABRB2
SCHEMBL6923871 0.87 L3MBTL1 (0.54) L3MBTL1GLO1HSP90AA1
SCHEMBL6920288 0.85 L3MBTL1 (0.53) L3MBTL1GLO1HSP90AA1MAPK1POLB
SCHEMBL6923317 0.77 L3MBTL1 (0.42) L3MBTL1GLO1POLBKMT2A
SCHEMBL1347360 0.71 GLO1 (0.44) L3MBTL1GLO1
SCHEMBL6827416 0.71 KMO (0.40) L3MBTL1KMT2A
SCHEMBL6827991 0.71 KMO (0.50) L3MBTL1MEN1POLBKMT2A
SCHEMBL6824261 0.69 PRKDC (0.41) HDAC3HDAC1HDAC2PRKDCCYP3A4
SCHEMBL11360635 0.68 L3MBTL1 (0.67) L3MBTL1GLO1HSP90AA1FAAHMGLL
SCHEMBL6827346 0.67 ATM (0.42) PRKDCGAAGABRA1

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
WO-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO claimed
WO-2004050624-A1 SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES C & C RESEARCH LABORATORIES (KR) 2004-06-17 WO disclosed