SCHEMBL25703136

SCHEMBL25703136

CC(C)(C)OC(=O)Nc1cccnc1C(=N)Br

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.60
BRD4 O60885 1/20 0.42
NAMPT P43490 1/20 0.41
TDP2 O95551 1/20 0.40
ATR Q13535 1/20 0.40
BRD9 Q9H8M2 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
CYP17A1 P05093 2/20 0.37
RAB9A P51151 1/20 0.37
PRMT1 Q99873 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
SCHEMBL13211408 0.85 METAP1 (0.64) METAP1BRD4NAMPTTDP2ATR
SCHEMBL31047027 0.85 METAP1 (0.64) METAP1BRD4NAMPTTDP2ATR
SCHEMBL30937705 0.85 METAP1 (0.64) METAP1BRD4NAMPTTDP2ATR
SCHEMBL4345991 0.83 METAP1 (0.62) METAP1BRD4NAMPTTDP2ATR
SCHEMBL1580424 0.80 METAP1 (0.55) METAP1BRD4NAMPTTDP2ATR
SCHEMBL30413190 0.80 METAP1 (0.55) METAP1BRD4NAMPTTDP2ATR
SCHEMBL30937714 0.80 METAP1 (0.59) METAP1BRD4NAMPTTDP2ATR
SCHEMBL4906896 0.79 BRD4 (0.70) METAP1BRD4TDP2ATRBRD9
SCHEMBL6868944 0.79 METAP1 (0.56) METAP1NAMPTTDP2ATRBRD9
SCHEMBL3243855 0.79 METAP1 (0.56) METAP1BRD4NAMPTTDP2ATR

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-2023094830-A1 SULFONAMIDE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS LARIO THERAPEUTICS LIMITED (GB) 2023-06-01 WO disclosed