SCHEMBL27467970

SCHEMBL27467970

Nc1nc(-c2ccccc2)n(CC=O)c(=O)c1C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
MAPT P10636 5/20 0.44
MAOB P27338 2/20 0.44
ADORA2A P29274 2/20 0.44
HSD17B10 Q99714 3/20 0.41
RAB9A P51151 3/20 0.41
TP53 P04637 1/20 0.41
ALDH1A1 P00352 5/20 0.41
GAA P10253 3/20 0.41
HPGD P15428 3/20 0.41
GLA P06280 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 3/20 0.41
PKM P14618 2/20 0.41
HTT P42858 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL27450256 0.94 ALDH1A1 (0.41) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27468455 0.93 MAPT (0.46) KDM4EMAPTMAOBADORA2AALDH1A1
SCHEMBL27449718 0.93 DHODH (0.42) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27468453 0.91 KMT2A (0.45) KDM4EMAPTHSD17B10ALDH1A1GAA
SCHEMBL27481472 0.90 RAB9A (0.44) KDM4ERAB9AALDH1A1KMT2AHTT
SCHEMBL27466584 0.88 KDM4E (0.44) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27467030 0.88 KDM4E (0.41) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27467028 0.86 ALDH1A1 (0.48) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27417159 0.80 DHODH (0.43) KDM4EMAPTMAOBADORA2AHSD17B10
SCHEMBL27451146 0.78 KDM4E (0.44) KDM4EMAPTMAOBADORA2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1188401-C Heterocyclic amide compound and its pharmaceutical use MITSUBISHI PHARMACEUTICAL CO L (JP) 2005-02-09 CN disclosed
CN-1131210-C Heterocyclic amide compound and medical use thereof MITSUBISHI SEIYAKU CO LTD (JP) 2003-12-17 CN disclosed
CN-1304931-A Heterocyclic amide compound and medical use thereof EFUKU CO LTD (JP) 2001-07-25 CN disclosed
CN-1188472-A Heterocyclic amide compound and medical use thereof GREEN CROSS CORP (JP) 1998-07-22 CN disclosed