SCHEMBL31370950

SCHEMBL31370950

COc1ccc(CN2C(=O)C(Br)Cc3ccccc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CASP3 P42574 2/20 0.51
APAF1 O14727 1/20 0.51
GAA P10253 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
GSK3B P49841 3/20 0.50
CMA1 P23946 1/20 0.49
DRD2 P14416 3/20 0.47
DRD4 P21917 3/20 0.47
CACNA1S Q13698 2/20 0.47
ADK P55263 1/20 0.47
GSK3A P49840 1/20 0.47
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL30100700 0.86 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL5221385 0.86 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL5668583 0.86 MEN1 (0.55) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL28844252 0.85 L3MBTL1 (0.53) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL14941450 0.82 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL30100736 0.82 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL30100771 0.81 L3MBTL1 (0.49) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL16163178 0.81 L3MBTL1 (0.49) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL16163298 0.78 L3MBTL1 (0.47) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL14938439 0.78 MEN1 (0.71) L3MBTL1MEN1KMT2ACASP3APAF1

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
CN-119384413-A Anilino-pyrazole derivatives, compositions and methods thereof 昂胜医药有限公司 2025-01-28 CN disclosed