SCHEMBL8444492

SCHEMBL8444492

CC(C)(NCCCn1cnc(CO)c1)c1ccc(Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QPCTL Q9NXS2 1/20 0.37
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
CPB2 Q96IY4 2/20 0.33
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KCNH2 Q12809 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
QPCT Q16769 1/20 0.33
NOTUM Q6P988 2/20 0.32
MAPT P10636 1/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32

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
SCHEMBL8446127 0.86 QPCT (0.38) CPB2KDM4EL3MBTL1QPCT
SCHEMBL7868474 0.86 CYP2C9 (0.40) QPCTLLMNACPB2CNR1CNR2
Hydrochloric Acid SCHEMBL7873720 0.85 TDP1 (0.41) QPCTLLMNACPB2CYP2C9CYP2C19
SCHEMBL8445998 0.84 QPCTL (0.48) QPCTLQPCT
SCHEMBL7877119 0.83 SMN1; SMN2 (0.40) QPCTLLMNACPB2KDM4EL3MBTL1
SCHEMBL7875247 0.81 ESRRG (0.42) SMN1; SMN2MAPT
SCHEMBL8446165 0.78 L3MBTL1 (0.49) QPCTLLMNAPKML3MBTL1NPSR1
SCHEMBL7876986 0.78 ALDH1A1 (0.41) LMNAKDM4ENPSR1SMN1; SMN2MAPT
SCHEMBL8443912 0.75 NOTUM (0.35) QPCTLLMNAL3MBTL1NPSR1KCNH2
SCHEMBL8443962 0.75 LMNA (0.56) LMNAPKMSMN1; SMN2CYP1A2CYP3A4

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
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