SCHEMBL8949535

SCHEMBL8949535

CC(C)(NCCCC(O)c1c[nH]cn1)c1ccc(Cl)cc1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL8446130 0.86 ADAMTS4 (0.35) SMN1; SMN2
SCHEMBL8443913 0.80 SMN1; SMN2 (0.34) NPSR1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL8443190 0.77 CYP17A1 (0.40) NPSR1
Hydrochloric Acid SCHEMBL8949238 0.76 CYP17A1 (0.39) NPSR1
SCHEMBL8443445 0.75 MEN1 (0.30) MEN1KMT2A
SCHEMBL9367627 0.72 TAAR1 (0.45) NPSR1L3MBTL1
SCHEMBL13975752 0.69 SMN1; SMN2 (0.54) NPSR1POLBSMN1; SMN2L3MBTL1CNR1
SCHEMBL7034295 0.69 KCNH2 (0.36)
SCHEMBL8446034 0.69 KMT2A (0.33) NPSR1SMN1; SMN2MEN1KMT2A
SCHEMBL9595179 0.68 BRS3 (0.38) NPSR1POLBSMN1; SMN2L3MBTL1CNR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5547972-A 1-(ARLALKYLAMINOALKYL) IMIDAZOLE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1996-08-20 US claimed
US-5547972-A 1-(ARLALKYLAMINOALKYL) IMIDAZOLE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1996-08-20 US disclosed
EP-0618907-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS Knoll AG (DE) 1994-10-12 EP disclosed
WO-1993013075-A1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed