SCHEMBL31448436

SCHEMBL31448436

Cc1ccc(-c2nc3ccccc3nc2N)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.69
L3MBTL1 Q9Y468 3/20 0.62
KDM4E B2RXH2 8/20 0.62
ALDH1A1 P00352 6/20 0.62
RAB9A P51151 3/20 0.62
MAPT P10636 3/20 0.62
POLB P06746 2/20 0.62
ADORA2A P29274 4/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
KMT2A Q03164 1/20 0.57
HPGD P15428 3/20 0.52
HSD17B10 Q99714 2/20 0.52
GAA P10253 1/20 0.52
CYP1A1 P04798 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP1B1 Q16678 1/20 0.51
DPP4 P27487 1/20 0.47
ADORA1 P30542 3/20 0.46
AKT1 P31749 1/20 0.46

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
SCHEMBL6341547 0.86 TDP1 (0.91) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL29215313 0.84 KDM4E (0.56) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL384076 0.84 KDM4E (0.61) TDP1L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL14733982 0.84 TDP1 (0.88) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL8407630 0.82 TDP1 (1.00) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL12630159 0.81 RAB9A (0.58) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL18136587 0.80 TDP1 (0.74) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL29610236 0.80 TDP1 (0.74) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL14819322 0.77 TDP1 (0.75) TDP1L3MBTL1KDM4EALDH1A1RAB9A
SCHEMBL13071764 0.77 TDP1 (0.75) TDP1L3MBTL1KDM4EALDH1A1RAB9A

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-119913525-A Electrochemical synthesis method of 3-aryl quinoxalinone compound 新疆大学 2025-05-02 CN disclosed