SCHEMBL8445865

SCHEMBL8445865

CCC(CC)(NC(=O)CCn1cnc(C=O)c1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASR P41180 7/20 0.34
DUT P33316 1/20 0.33
HPGD P15428 2/20 0.32
KMT2A Q03164 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
CTSB P07858 1/20 0.31
KDM5A P29375 2/20 0.31
KDM4C Q9H3R0 2/20 0.31
KDM5B Q9UGL1 2/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
KDM4A O75164 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31

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
SCHEMBL8445891 0.81 ADAMTS4 (0.39) KMT2A
SCHEMBL7877324 0.80 CASR (0.33) CASRDUTHPGDTP53
SCHEMBL8443495 0.77 CYP11B1 (0.49) KMT2A
SCHEMBL7876923 0.76 CNR1 (0.37) HPGDKMT2ATP53TSHR
SCHEMBL8949198 0.73 SSTR4 (0.39) HDAC1HDAC2
SCHEMBL19359838 0.72 EGLN3 (0.43) KMT2AKDM5AKDM5B
SCHEMBL19359839 0.70 KAT2B (0.35) HPGDKMT2ATP53TSHR
SCHEMBL14411529 0.68 LMNA (0.41) CASRKMT2AHDAC1HDAC2
SCHEMBL3910931 0.67 KDM5A (0.41) KDM5AKDM5B
SCHEMBL6496954 0.67 HTT (0.41) KMT2AKDM5AKDM4CKDM5B

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 4 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
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