SCHEMBL11142887

SCHEMBL11142887

CC(=O)N1CC/C(=N/O)c2cc(Cl)ccc21

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 10/20 0.61
HSD17B3 P37058 3/20 0.46
HTT P42858 2/20 0.44
TRIM24 O15164 1/20 0.43
AVPR1A P37288 1/20 0.43
HDAC2 Q92769 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 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
SCHEMBL11142890 1.00 NOTUM (0.61) NOTUMHSD17B3HTTTRIM24AVPR1A
SCHEMBL11064543 0.85 NOTUM (0.44) NOTUMHSD17B3HTTTRIM24HDAC2
SCHEMBL11136783 0.85 NOTUM (0.44) NOTUMHSD17B3HTTTRIM24AVPR1A
SCHEMBL9803712 0.85 NOTUM (0.44) NOTUMHTTHDAC2POLBMAPT
SCHEMBL9803972 0.85 NOTUM (0.44) NOTUMHTTHDAC2POLBMAPT
SCHEMBL11148186 0.85 NOTUM (0.44) NOTUMHTTHDAC2POLBMAPT
SCHEMBL11136781 0.85 NOTUM (0.44) NOTUMHSD17B3HTTTRIM24AVPR1A
SCHEMBL11145384 0.85 NOTUM (0.44) NOTUMHSD17B3HTTAVPR1AHDAC2
SCHEMBL11145387 0.85 NOTUM (0.44) NOTUMHSD17B3HTTAVPR1AHDAC2
SCHEMBL11137786 0.85 NOTUM (0.44) NOTUMHSD17B3HTTTRIM24HDAC2

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-4421919-A ANTIEDEMIC, DIURETIC, HYPOTENSIVE HODOGAYA CHEMICAL CO., LTD. (JP) 1983-12-20 US disclosed