SCHEMBL8949396

SCHEMBL8949396

CC(NC(=O)C(C)(C)CCl)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
PRCP P42785 2/20 0.46
GRN P28799 1/20 0.46
SORT1 Q99523 1/20 0.46
CNR1 P21554 5/20 0.45
CNR2 P34972 2/20 0.45
GPR139 Q6DWJ6 3/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
FFAR2 O15552 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
SCHEMBL8443983 0.83 GAA (0.54) SMN1; SMN2GAAHPGDPRCPCNR1
SCHEMBL11298431 0.79 GPR139 (0.48) SMN1; SMN2GAAHPGDPRCPGPR139
SCHEMBL9439080 0.77 GAA (0.48) SMN1; SMN2GAAHPGDPRCPCNR1
SCHEMBL7897298 0.77 SMN1; SMN2 (0.69) SMN1; SMN2GAAHPGDPRCPGPR139
SCHEMBL8444499 0.76 LMNA (0.47) LMNAMEN1KMT2A
SCHEMBL9371746 0.76 FFAR2 (0.45) SMN1; SMN2GAAHPGDPRCPGRN
SCHEMBL7674958 0.74 GAA (0.58) SMN1; SMN2GAAHPGDPRCPCNR1
SCHEMBL22279548 0.74 GAA (0.58) SMN1; SMN2GAAHPGDPRCPGPR139
SCHEMBL2651517 0.74 GAA (0.58) SMN1; SMN2GAAHPGDPRCPCNR1
SCHEMBL6392377 0.74 GAA (0.58) SMN1; SMN2GAAHPGDPRCPGPR139

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 3 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 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