SCHEMBL11675676

SCHEMBL11675676

CCN(CC(CCl)OC(=O)Nc1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ NOX1 Q9Y5S8 2/20 0.49
▸ MAPT P10636 5/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ HTT P42858 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ LMNA P02545 4/20 0.41
▸ GRM5 P41594 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ DRD4 P21917 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ CCKAR P32238 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SCN1A P35498 1/20 0.41
▸ OPRK1 P41145 1/20 0.41

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
SCHEMBL11680348 0.90 MEN1 (0.51) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL11713942 0.84 KMT2A (0.40) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL10388014 0.82 DRD4 (0.51) KMT2AMEN1RAB9ANPC1MAPT
SCHEMBL11676337 0.82 CNR2 (0.42) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL11676164 0.73 MEN1 (0.50) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL10409304 0.73 KMT2A (0.50) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL11379075 0.72 SLC18A3 (0.44) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL10409305 0.71 SMN1; SMN2 (0.57) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL11678680 0.71 MEN1 (0.48) KMT2AMEN1RAB9ANPC1NOX1
SCHEMBL22459216 0.71 CTSK (0.48) KMT2AMEN1RAB9ANPC1MAPT

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
US-4051117-A Triazole-azo-phenyl cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 — — US disclosed
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