SCHEMBL7654427

SCHEMBL7654427

O=c1nc(-c2ccccc2)[nH]n1-c1ccc(Cl)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
KMT2A Q03164 6/20 0.51
MEN1 O00255 5/20 0.51
HPGD P15428 4/20 0.51
ALDH1A1 P00352 3/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
GAA P10253 3/20 0.47
NPC1 O15118 2/20 0.47
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
MAPT P10636 4/20 0.44
LMNA P02545 2/20 0.44
CXCR2 P25025 1/20 0.43
TNKS O95271 1/20 0.43
GUSB P08236 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
PARP2 Q9UGN5 1/20 0.43
NR1H2 P55055 1/20 0.43

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
SCHEMBL7660381 0.94 KMT2A (0.54) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7650665 0.89 KDM4E (0.64) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7656717 0.85 MEN1 (0.53) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7652940 0.84 KDM4E (0.51) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7656771 0.84 RAD51 (0.46) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7653827 0.81 KDM4E (0.48) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7651292 0.80 GABRA1 (0.43) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7656234 0.79 ALDH1A1 (0.53) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7652511 0.78 KDM4E (0.51) KDM4EKMT2AMEN1HPGDALDH1A1
SCHEMBL7650494 0.78 KDM4E (0.45) KDM4EKMT2AMEN1HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492407-B2 NEUROPROTECTIVE ACTIVITY BOEHRINGER IMGELHEIM PHARMA KG (DE) 2002-12-10 US disclosed