SCHEMBL7653827

SCHEMBL7653827

COc1ccc(-n2[nH]c(-c3ccccc3)nc2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
ALDH1A1 P00352 4/20 0.48
HPGD P15428 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
TNKS O95271 1/20 0.47
GUSB P08236 1/20 0.47
PARP1 P09874 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
TNKS2 Q9H2K2 1/20 0.47
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
GABRA1 P14867 1/20 0.46

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
SCHEMBL7659636 0.94 MEN1 (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7656036 0.86 ALKBH5 (0.50) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7650665 0.85 KDM4E (0.64) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7652940 0.84 KDM4E (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7654427 0.81 KDM4E (0.60) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7652511 0.78 KDM4E (0.51) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7657337 0.77 MGLL (0.46) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7656234 0.76 ALDH1A1 (0.53) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7660381 0.75 KMT2A (0.54) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL7652917 0.74 GAA (0.52) KDM4EALDH1A1HPGDMEN1KMT2A

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