SCHEMBL9616337

SCHEMBL9616337

CCc1nc(C)c(C)c(=O)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
TP53 P04637 1/20 0.54
TNKS2 Q9H2K2 1/20 0.46
HTT P42858 1/20 0.44
ADORA3 P0DMS8 4/20 0.39
ADORA1 P30542 4/20 0.39
ADORA2A P29274 2/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 2/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
SRC P12931 1/20 0.37
CCNE2 O96020 1/20 0.37
CDK4 P11802 1/20 0.37
CCND1 P24385 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
ACVR1 Q04771 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
SCHEMBL5935686 0.81 TP53 (0.53) L3MBTL1TP53TNKS2HTTKMT2A
SCHEMBL14636999 0.81 KMT2A (0.41) L3MBTL1TP53TNKS2HTTKMT2A
SCHEMBL9487922 0.80 PARP1 (0.51) L3MBTL1TP53ALDH1A1KDM4E
SCHEMBL15427229 0.79 L3MBTL1 (0.51) L3MBTL1TP53TNKS2HTTADORA3
SCHEMBL18294954 0.78 SMN1; SMN2 (0.55) L3MBTL1TP53TNKS2HTTKMT2A
SCHEMBL4283741 0.75 L3MBTL1 (0.41) L3MBTL1TP53TNKS2HTTADORA3
SCHEMBL25778574 0.75 KDM4E (0.55) L3MBTL1TP53HTTKMT2ALMNA
SCHEMBL12143535 0.74 L3MBTL1 (0.46) L3MBTL1TP53TNKS2HTTKMT2A
SCHEMBL2020536 0.72
SCHEMBL172127 0.72 ALDH1A1 (0.58) L3MBTL1TNKS2KMT2ALMNAHPGD

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
EP-0514192-A1 Antihypertensive benzofuran derivatives, substituted by varied N-pyrimidinyl- or N-imidazolyl-methyl groups GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed