SCHEMBL27330801

SCHEMBL27330801

O=Cc1ncccc1Nc1ccccn1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
MAPK10 P53779 1/20 0.63
GFER P55789 1/20 0.63
NPC1 O15118 6/20 0.42
RAB9A P51151 6/20 0.42
PKM P14618 1/20 0.42
GRM5 P41594 1/20 0.40
GAA P10253 1/20 0.40
ADRA2A P08913 2/20 0.39
ADRA2B P18089 2/20 0.39
ADRA2C P18825 2/20 0.39
KDR P35968 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MITF O75030 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
TLR4 O00206 1/20 0.38
TLR2 O60603 1/20 0.38

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
SCHEMBL31485690 0.81 DHODH (0.44) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL3279571 0.79 MEN1 (1.00) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL5771649 0.73 MAPK10 (0.70) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL2501726 0.73 KMT2A (0.70) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL29391624 0.72 KMT2A (0.76) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL221242 0.72 KMT2A (0.76) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL30167997 0.72 MEN1 (0.76) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL3265731 0.72 MEN1 (0.76) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL29274138 0.71 MEN1 (0.56) MEN1KMT2AMAPK10GFERNPC1
SCHEMBL31220877 0.71 MAPK10 (0.73) MEN1KMT2AMAPK10GFERNPC1

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
CN-1043344-C New heterocyclic compounds KRONSEDER MASCHF KRONES (JP) 1999-05-12 CN claimed