SCHEMBL31346705

SCHEMBL31346705

CCOC(=O)c1ccc(CON2C(=O)c3ccccc3C2=O)o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.52
TSHR P16473 4/20 0.52
HSD17B10 Q99714 4/20 0.52
KDM4E B2RXH2 4/20 0.52
MAPT P10636 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 2/20 0.45
HTT P42858 1/20 0.45
TLR2 O60603 1/20 0.45
NSD2 O96028 1/20 0.45
PKM P14618 1/20 0.45
MPI P34949 1/20 0.45
GRK6 P43250 1/20 0.45
RECQL P46063 1/20 0.45

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
SCHEMBL13141243 1.00 ALDH1A1 (0.52) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL5064689 0.82 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL13141337 0.78 ALDH1A1 (0.43) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL13140912 0.76 CA12 (0.53) ALDH1A1TSHRKDM4EMAPTNPC1
SCHEMBL2090871 0.75 NPC1 (0.60) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL18263632 0.75 NPC1 (0.60) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL31346658 0.75 HSD17B10 (0.45) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL13140570 0.75 HSD17B10 (0.45) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL916814 0.75 ALDH1A1 (0.54) ALDH1A1TSHRHSD17B10KDM4EMAPT
SCHEMBL7498200 0.74 L3MBTL1 (0.59) ALDH1A1TSHRHSD17B10KDM4EMAPT

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-119390668-A Compound with ketoxime ether structure and application thereof 复旦大学 2025-02-07 CN disclosed