SCHEMBL7126453

SCHEMBL7126453

CCNC(=O)c1ccc(Cl)cc1.c1ccc(-n2ccnc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP4Z1 Q86W10 1/20 0.54
CYP24A1 Q07973 3/20 0.52
CYP27B1 O15528 2/20 0.52
ADRB1 P08588 1/20 0.52
NOTUM Q6P988 1/20 0.51
CYP3A4 P08684 2/20 0.50
HTT P42858 1/20 0.49
BAZ2B Q9UIF8 1/20 0.49
LSS P48449 1/20 0.48
ADH5 P11766 1/20 0.47
IDO1 P14902 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9368933 0.87 CYP3A4 (0.63) MAPTL3MBTL1CYP4Z1ADRB1CYP3A4
SCHEMBL7068038 0.82 TBXAS1 (0.52) MAPTL3MBTL1CYP4Z1ADRB1HTT
SCHEMBL7071393 0.82 TBXAS1 (0.52) MAPTL3MBTL1CYP4Z1ADRB1HTT
SCHEMBL7072586 0.82 TBXAS1 (0.52) MAPTL3MBTL1CYP4Z1ADRB1HTT
SCHEMBL4674989 0.77 CYP3A4 (0.60) MAPTL3MBTL1CYP4Z1ADRB1CYP3A4
SCHEMBL8508590 0.76 CYP4Z1 (0.65) MAPTL3MBTL1CYP4Z1ADRB1ADH5
SCHEMBL4146583 0.76 MEN1 (0.69) MAPTL3MBTL1HTTSMN1; SMN2
SCHEMBL8795454 0.74 DRD3 (0.58) ADRB1CYP3A4HTTSMN1; SMN2
SCHEMBL5947724 0.74 EPHX2 (0.64) MAPTL3MBTL1CYP4Z1ADRB1ADH5
SCHEMBL7068530 0.73 NAAA (0.63) L3MBTL1CYP4Z1CYP3A4HTTBAZ2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003045381-A1 AMINOALKYLIMIDAZOLE DERIVATIVES AND THEIR USE IN MEDICINE MOLECULAR SKINCARE LIMITED (GB) 2003-06-05 WO claimed
WO-2003045381-A1 AMINOALKYLIMIDAZOLE DERIVATIVES AND THEIR USE IN MEDICINE MOLECULAR SKINCARE LIMITED (GB) 2003-06-05 WO disclosed