SCHEMBL5024409

SCHEMBL5024409

ON=CCc1ccc(Cl)cc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.42
CYP3A4 P08684 5/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HIF1A Q16665 4/20 0.42
ALOX15 P16050 4/20 0.42
MAPT P10636 3/20 0.42
HSP90AA1 P07900 3/20 0.42
IDO1 P14902 3/20 0.42
HTT P42858 3/20 0.42
ALOX12 P18054 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 2/20 0.42
HSPA5 P11021 2/20 0.42
SLC22A1 O15245 1/20 0.42
USP2 O75604 1/20 0.42
HSPD1 P10809 1/20 0.42
CASP1 P29466 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42

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
SCHEMBL5718432 0.83 IDO1 (0.48) CYP3A4MEN1KMT2AALOX15MAPT
SCHEMBL3934466 0.81 TYR (0.54) CYP3A4MEN1KMT2AALOX15MAPT
SCHEMBL2144792 0.78 ALOX15 (0.38) HPGDKMT2AALOX15MAPTHTT
SCHEMBL4573203 0.78 ALOX15 (0.38) HPGDKMT2AALOX15MAPTHTT
SCHEMBL2318939 0.77 ERN1 (0.47) HPGDCYP3A4MEN1KMT2AHIF1A
SCHEMBL5807459 0.77 GABRA1 (0.50) HPGDCYP3A4MEN1KMT2AHIF1A
SCHEMBL51173 0.73 CYP3A4 (0.67) HPGDCYP3A4MEN1KMT2AHIF1A
SCHEMBL7012686 0.72 HSPA5 (0.50) HPGDCYP3A4HIF1AALOX15MAPT
SCHEMBL561006 0.71 CYP3A4 (0.52) HPGDCYP3A4MEN1KMT2AHIF1A
SCHEMBL28534044 0.70 CYP3A4 (0.50) HPGDCYP3A4MEN1KMT2AHIF1A

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
EP-1983992-A2 2-IMINO-BENZIMIDAZOLES Abbott Laboratories (US) 2008-10-29 EP disclosed
WO-2007084728-A2 2-IMINO-BENZIMIDAZOLES ABBOTT LABORATORIES (US) 2007-07-26 WO disclosed