SCHEMBL8445940

SCHEMBL8445940

Cc1cncn1CCCNCc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
QPCT Q16769 8/20 0.48
HRH4 Q9H3N8 2/20 0.46
HRH3 Q9Y5N1 2/20 0.46
KDM4E B2RXH2 1/20 0.46
THRB P10828 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
QPCTL Q9NXS2 1/20 0.45
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
POLB P06746 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 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
SCHEMBL14416029 0.86 CHRM2 (0.50) CHRM2QPCTQPCTL
SCHEMBL14416019 0.86 QPCT (0.51) CHRM2QPCTTDP1SIGMAR1
SCHEMBL14416021 0.80 CHRM2 (0.58) CHRM2QPCT
SCHEMBL8444561 0.78 CHRM2 (0.50) CHRM2SMN1; SMN2HRH4HRH3KDM4E
Hydrochloric Acid SCHEMBL8446045 0.77 CHRM2 (0.49) CHRM2SMN1; SMN2HRH4HRH3KDM4E
SCHEMBL14416032 0.77 MEN1 (0.47) CHRM2QPCTHRH4TDP1SIGMAR1
SCHEMBL8446202 0.76 QPCT (0.47) QPCTQPCTL
SCHEMBL8443441 0.76 QPCT (0.47) QPCTQPCTL
SCHEMBL8443763 0.76 CHRM2 (0.50) CHRM2SMN1; SMN2HRH4HRH3KDM4E
SCHEMBL8443179 0.76 ALDH1A1 (0.50) CHRM2SMN1; SMN2KDM4ETHRBTDP1

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 5 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
EP-0618907-B1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS BRITISH TECH GROUP INT (GB) 1999-04-28 EP disclosed
US-5547972-A 1-(ARLALKYLAMINOALKYL) IMIDAZOLE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1996-08-20 US disclosed
WO-1995022327-A1 USE OF 1-(ARYLALKYLAMINOALKYL) IMIDAZOLES FOR TREATING NEUROLOGICAL DAMAGE KNOLL AG (DE) 1995-08-24 WO 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