SCHEMBL3356548

SCHEMBL3356548

C=CC(O)c1cc2ncnc(Oc3ccccc3)c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TRPA1 O75762 1/20 0.36
THRB P10828 1/20 0.36
MAP3K7 O43318 1/20 0.36
TAB1 Q15750 1/20 0.36
CSF1R P07333 5/20 0.35
EGFR P00533 3/20 0.34
KDM5A P29375 2/20 0.34
MRGPRX1 Q96LB2 1/20 0.34
KDM4C Q9H3R0 3/20 0.34
KDM5B Q9UGL1 1/20 0.34
KDM4A O75164 1/20 0.34
BTK Q06187 2/20 0.33
ERBB2 P04626 1/20 0.33
KDR P35968 2/20 0.32
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL2748518 0.76 KDM4C (0.38) MEN1KMT2ATRPA1THRBCSF1R
SCHEMBL2748271 0.73 MEN1 (0.43) MEN1KMT2ATRPA1THRBCSF1R
SCHEMBL2748797 0.73 KDM4C (0.45) MEN1KMT2ATRPA1THRBMAP3K7
SCHEMBL2747947 0.73 TRPA1 (0.40) MEN1KMT2ATRPA1THRBMAP3K7
SCHEMBL2749079 0.73 KMT2A (0.45) MEN1KMT2ATRPA1MAP3K7TAB1
SCHEMBL2748398 0.72 TRPA1 (0.37) MEN1KMT2ATRPA1THRBMAP3K7
SCHEMBL2748394 0.72 TRPA1 (0.37) MEN1KMT2ATRPA1THRBMAP3K7
SCHEMBL2748675 0.71 RHEB (0.43) TRPA1MAP3K7TAB1CSF1RKDR
SCHEMBL2748586 0.70 TRPA1 (0.40) MEN1KMT2ATRPA1THRBCSF1R
SCHEMBL2747995 0.65 TK1 (0.36) MEN1KMT2AMAP3K7TAB1CSF1R

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-2010036910-A1 HEART PROTECTION BY ADMINISTERING AN AMP-ACTIVATED PROTEIN KINASE ACTIVATOR OHTA YOSHIKAZU (JP) 2010-04-01 WO disclosed