SCHEMBL2568709

SCHEMBL2568709

CCOC(=O)Oc1nc(NC(=O)Nc2ccc(Cl)cc2C)cn1CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 5/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.35
KDR P35968 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL2570520 0.90 MEN1 (0.39) MEN1KMT2ATP53LMNAPOLB
SCHEMBL1594765 0.87 TP53 (0.40) MEN1KMT2ATP53LMNAPOLB
SCHEMBL1594449 0.81 MEN1 (0.41) MEN1KMT2ATP53LMNAPOLB
SCHEMBL13197780 0.81 CHRM1 (0.36) MEN1KMT2ATP53LMNAALDH1A1
SCHEMBL14786459 0.77 POLB (0.46) LMNAPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL2568640 0.76 MAPT (0.39) MEN1KMT2ATP53LMNAPOLB
SCHEMBL2572026 0.75 P2RX7 (0.48) KMT2ATP53LMNAPOLBMAPT
SCHEMBL12706245 0.74 LMNA (0.39) MEN1KMT2ATP53LMNAPOLB
SCHEMBL2569125 0.74 MAPT (0.39) MEN1KMT2ATP53POLBALDH1A1
SCHEMBL2572466 0.73 MAPK1 (0.37) MEN1KMT2ATP53POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732901-B1 ANTIVIRAL 4-AMINOCARBONYLAMINO-SUBSTITUTED IMIDAZOLE COMPOUND AICURIS GMBH & CO KG (DE) 2011-11-02 EP disclosed
EP-1853582-B1 HETEROCYCLYLAMIDE-SUBSTITUTED IMIDAZOLES AICURIS GMBH & CO KG (DE) 2009-10-21 EP disclosed
EP-1853582-A2 HETEROCYCLYLAMIDE-SUBSTITUTED IMIDAZOLES AiCuris GmbH & Co. KG (DE) 2007-11-14 EP disclosed
EP-1732901-A1 ANTIVIRAL 4-AMINOCARBONYLAMINO-SUBSTITUTED IMIDAZOLE COMPOUND Bayer HealthCare AG (DE) 2006-12-20 EP disclosed
WO-2006089664-A2 HETEROCYCLYLAMIDE-SUBSTITUTED IMIDAZOLES AICURIS GMBH & CO. KG (DE) 2006-08-31 WO disclosed
WO-2005092865-A1 ANTIVIRAL 4-AMINOCARBONYLAMINO-SUBSTITUTED IMIDAZOLE COMPOUND BAYER HEALTHCARE AG (DE) 2005-10-06 WO disclosed