SCHEMBL20031279

SCHEMBL20031279

Cc1cc2c(cn1)c(C(=O)O)cn2C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MAP3K5 Q99683 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL15031277 0.75 MAP3K5 (0.45) MAP3K5MAPT
SCHEMBL10254311 0.75 KMT2A (0.49) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL24900930 0.72 KMT2A (0.47) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL12483796 0.72 NR4A2 (0.45) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL12167181 0.71 KMT2A (0.56) KMT2AMEN1LMNAPOLBKDM4E
SCHEMBL30622587 0.71 KMT2A (0.56) KMT2AMEN1LMNAPOLBKDM4E
SCHEMBL29715820 0.71 MEN1 (0.49) KMT2AMEN1LMNAPOLBNR4A2
SCHEMBL18911990 0.71 MEN1 (0.46) KMT2AMEN1MAPTLMNAPOLB
SCHEMBL2300491 0.71 MAP3K5 (0.48) KMT2AMEN1MAP3K5GABRPGABRD
SCHEMBL19657567 0.71 NR4A2 (0.52) KMT2AMEN1MAP3K5MAPTKDM4E

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-2018059314-A1 AZABICYCLE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2018-04-05 WO disclosed