SCHEMBL8446798

SCHEMBL8446798

CCOC(=O)c1c(C)ncn1CCCNC(C)(C)c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.39
THRB P10828 1/20 0.37
KDM4E B2RXH2 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 3/20 0.36
RECQL P46063 1/20 0.35
MAPK10 P53779 1/20 0.35
ALDH1A1 P00352 4/20 0.35
KMT2A Q03164 2/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
LMNA P02545 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
GAA P10253 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
P2RY12 Q9H244 1/20 0.35
ELANE P08246 1/20 0.34

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
SCHEMBL8949210 0.84 ALDH1A1 (0.38) SMN1; SMN2THRBKDM4ENPC1RAB9A
SCHEMBL8443123 0.80 NPSR1 (0.33) SMN1; SMN2NPC1NPSR1CNR1CNR2
SCHEMBL8446032 0.77 SMN1; SMN2 (0.35) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
Hydrochloric Acid SCHEMBL8447331 0.76 SMN1; SMN2 (0.34) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL8443912 0.74 NOTUM (0.35) SMN1; SMN2NPSR1CNR1CNR2LMNA
SCHEMBL8949213 0.73 SMN1; SMN2 (0.39) SMN1; SMN2KDM4ENPC1RAB9AHPGD
SCHEMBL4125342 0.72 TNF (0.40) SMN1; SMN2KDM4EHPGDMAPTRECQL
SCHEMBL9367765 0.71 KMT2A (0.39) SMN1; SMN2KDM4ENPC1RAB9AHPGD
SCHEMBL8447444 0.71 POLB (0.41) SMN1; SMN2THRBMAPTALDH1A1KMT2A
SCHEMBL8443490 0.71 CA12 (0.47) SMN1; SMN2KDM4EALDH1A1KMT2ALMNA

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
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
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