SCHEMBL25348233

SCHEMBL25348233

O=C(Nc1ccc(Cl)cc1)c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 0.56
TOP2A P11388 1/20 0.56
TOP2B Q02880 1/20 0.56
PRSS12 P56730 1/20 0.55
MAPK1 P28482 2/20 0.54
MAPT P10636 3/20 0.53
P2RX1 P51575 1/20 0.53
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
KMT2A Q03164 6/20 0.50
MEN1 O00255 4/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
NQO2 P16083 1/20 0.50
P4HTM Q9NXG6 1/20 0.50
NT5E P21589 1/20 0.50
GAA P10253 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
EGFR P00533 1/20 0.50

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
SCHEMBL25347749 0.83 SNCA (0.67) TOP1TOP2ATOP2BMAPK1MAPT
SCHEMBL7120565 0.83 P2RX1 (0.53) PRSS12MAPK1MAPTP2RX1NPC1
SCHEMBL12825037 0.83 MEN1 (0.60) TOP1TOP2ATOP2BPRSS12MAPK1
SCHEMBL12644447 0.83 HSPD1 (0.64) TOP1TOP2ATOP2BMAPK1MAPT
SCHEMBL25348176 0.83 TOP1 (0.59) TOP1TOP2ATOP2BMAPK1MAPT
SCHEMBL25350384 0.81 ABCB1 (0.63) MAPK1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL4355842 0.81 MEN1 (0.57) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL25349190 0.81 MAPT (0.54) TOP1TOP2ATOP2BMAPK1MAPT
SCHEMBL17295638 0.81 NQO2 (0.60) TOP1TOP2ATOP2BPRSS12MAPK1
SCHEMBL11679716 0.80 KMT2A (0.80) PRSS12MAPK1MAPTP2RX1NPC1

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-2023149548-A1 NOVEL PHARMACEUTICAL COMPOSITION 国立大学法人富山大学 2023-08-10 WO disclosed