SCHEMBL8949671

SCHEMBL8949671

Cc1cn(CCCNCc2ccc(Cl)cc2)c(Cc2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.46
TMEM97 Q5BJF2 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
CHRM2 P08172 2/20 0.43
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.40
THRB P10828 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAOA P21397 1/20 0.39
POLB P06746 1/20 0.39
BCHE P06276 1/20 0.39
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8444335 0.84 TMEM97 (0.45) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA
SCHEMBL8443763 0.82 CHRM2 (0.50) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA
SCHEMBL8949255 0.81 HTR1A (0.43) SMN1; SMN2CHRM2LMNATP53KMT2A
Hydrochloric Acid SCHEMBL8445897 0.81 CHRM2 (0.49) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA
SCHEMBL14416024 0.79 MAOA (0.49) SIGMAR1CHRM2TDP1MAOAKMT2A
SCHEMBL8949346 0.77 TMEM97 (0.46) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA
SCHEMBL8443893 0.75 TLR8 (0.44) SIGMAR1SMN1; SMN2LMNATP53MAOA
SCHEMBL9371691 0.74 GRM5 (0.40) SIGMAR1SMN1; SMN2LMNATP53KMT2A
SCHEMBL8445814 0.69 CHRM2 (0.50) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA
SCHEMBL8443179 0.69 ALDH1A1 (0.50) SIGMAR1TMEM97SMN1; SMN2CHRM2LMNA

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
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
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