SCHEMBL8949198

SCHEMBL8949198

CC(C)(NC(=O)CCn1cnc(C=O)c1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
MAPK1 P28482 1/20 0.34
PRCP P42785 2/20 0.33
MAPT P10636 3/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32
FLT1 P17948 1/20 0.32
KDR P35968 1/20 0.32
WDR5 P61964 1/20 0.31
ANO1 Q5XXA6 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL7876923 0.88 CNR1 (0.37) PRCPMAPTPOLBALDH1A1ANO1
SCHEMBL8445891 0.82 ADAMTS4 (0.39) MAPK1PRCPMAPT
SCHEMBL8446813 0.77 HDAC3 (0.40) SSTR4HDAC3HDAC1HDAC2HDAC6
SCHEMBL9373918 0.76 LMNA (0.37) MAPK1POLBALDH1A1WDR5
SCHEMBL8446891 0.73 QPCTL (0.41) MAPK1PRCPMAPTPOLBALDH1A1
SCHEMBL8445865 0.73 CASR (0.34) HDAC1HDAC2
SCHEMBL9372341 0.71 SSTR4 (0.41) SSTR4HDAC3HDAC1HDAC2HDAC6
SCHEMBL8447455 0.69 L3MBTL1 (0.53) MAPK1PRCPMAPTPOLBALDH1A1
SCHEMBL7875302 0.68 CNR1 (0.41) HDAC3HDAC1HDAC2MAPK1PRCP
SCHEMBL19359839 0.68 KAT2B (0.35) MAPTALDH1A1

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