SCHEMBL25824559

SCHEMBL25824559

CC(C)(C)n1c(=O)[nH]c2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.50
NT5C2 P49902 2/20 0.44
NT5E P21589 1/20 0.42
CSF1R P07333 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HTT P42858 1/20 0.40
ADORA3 P0DMS8 3/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
CREBBP Q92793 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
EGFR P00533 1/20 0.38
AURKB Q96GD4 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
VCP P55072 2/20 0.37
PSMC4 P43686 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
SCHEMBL23240669 0.84 BRD4 (0.53) BRD4NT5C2NT5ECSF1RTDP1
SCHEMBL25823819 0.83 KDM4E (0.42) HTTPOLBNPC1RAB9ATP53
SCHEMBL18349587 0.72 NPC1 (0.51) BRD4HTTADORA3POLBPKM
SCHEMBL12942226 0.72 ABL1 (0.47) NPC1RAB9AEGFRAURKB
SCHEMBL3784641 0.71 MAPK14 (0.55) BRD4POLBPKMNPC1RAB9A
SCHEMBL29673051 0.71 ADK (0.49) TDP1HTTADORA3NPC1RAB9A
SCHEMBL23216968 0.71 ADK (0.49) TDP1HTTADORA3NPC1RAB9A
SCHEMBL13020230 0.70 VCP (0.53) BRD4HTTADORA3POLBPKM
SCHEMBL23215743 0.69 ADK (0.46) BRD4CSF1RADORA3POLBADORA2A
SCHEMBL29673049 0.69 ADK (0.46) BRD4CSF1RADORA3POLBADORA2A

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
US-20240026358-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2024-01-25 US disclosed
US-20230220384-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-07-13 US disclosed