SCHEMBL14728838

SCHEMBL14728838

Brc1ccc(/N=C/c2ccccc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
RAB9A P51151 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HTT P42858 2/20 0.54
BLM P54132 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
POLB P06746 2/20 0.54
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 4/20 0.48
ADRA2A P08913 2/20 0.44
ADRA2B P18089 2/20 0.44
ADRA2C P18825 2/20 0.44
PLAU P00749 1/20 0.44
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.37

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
SCHEMBL14728791 0.83 PKM (0.54) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728836 0.83 KMT2A (0.44) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728802 0.81 RAB9A (0.49) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728832 0.81 CHRM5 (0.49) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728822 0.79 APP (0.46) MAPTRAB9AMEN1KMT2AALDH1A1
SCHEMBL14728847 0.77 KDM4E (0.44) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728816 0.77 KDM4E (0.44) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL15209207 0.76 KMT2A (0.42) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL15209208 0.76 KMT2A (0.42) MAPTRAB9AMEN1KMT2AHTT
SCHEMBL14728827 0.76 KMT2A (0.41) MAPTRAB9AMEN1KMT2AHTT

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
WO-2013026357-A1 PREPARATION METHOD OF IMIDAZOLE DERIVATIVES 北京欧博方医药科技有限公司 (CN) 2013-02-28 WO disclosed