SCHEMBL25815441

SCHEMBL25815441

Cc1cc(C(=O)OC(C)(C)C)nn1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.53
KDM4E B2RXH2 3/20 0.42
GAA P10253 2/20 0.42
RAB9A P51151 2/20 0.42
KMT2A Q03164 1/20 0.42
NR2E1 Q9Y466 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
GABRG2 P18507 6/20 0.37
GABRB3 P28472 6/20 0.37
GABRA5 P31644 5/20 0.37
GABRA1 P14867 5/20 0.37
GABRA3 P34903 5/20 0.37
GABRA2 P47869 5/20 0.37
GABRA4 P48169 3/20 0.37
GABRA6 Q16445 3/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRB2 P47870 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
SCHEMBL31336669 0.89 BAZ2B (0.41) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL31336826 0.81 GABRG2 (0.36) BAZ2BKDM4EKMT2AGABRG2GABRB3
SCHEMBL2246566 0.80 BAZ2B (0.62) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL1233517 0.77 BAZ2B (0.54) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL12868356 0.77 BAZ2B (0.58) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL27163039 0.76 MEN1 (0.39) KDM4ERAB9AKMT2AALDH1A1LMNA
SCHEMBL27166556 0.75 LMNA (0.51) KDM4EGAARAB9AKMT2ALMNA
SCHEMBL27787704 0.75 BAZ2B (0.66) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL357627 0.74 BAZ2B (0.63) BAZ2BKDM4EGAARAB9AKMT2A
SCHEMBL222289 0.74 BAZ2B (0.63) BAZ2BKDM4EGAARAB9AKMT2A

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-2023130043-A1 MONOACYLGLYCEROL LIPASE INHIBITORS AND USE THEREOF FOR THE TREATMENT OF ANXIETY PSY THERAPEUTICS, INC. (US) 2023-07-06 WO disclosed