SCHEMBL31619086

SCHEMBL31619086

Cc1oc(CBr)cc1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.66
GLA P06280 1/20 0.65
APEX1 P27695 4/20 0.62
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
POLB P06746 3/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALDH1A1 P00352 3/20 0.51
HSD17B10 Q99714 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALOX15 P16050 1/20 0.51
LIG1 P18858 1/20 0.51
MAPT P10636 3/20 0.47
GAA P10253 1/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 2/20 0.39

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
SCHEMBL11722067 0.82 TTR (0.68) TTRGLAAPEX1NPC1RAB9A
SCHEMBL19834868 0.82 TTR (0.68) TTRGLAAPEX1NPC1RAB9A
SCHEMBL2162290 0.81 TTR (0.66) TTRGLAAPEX1NPC1RAB9A
SCHEMBL13402297 0.79 TTR (1.00) TTRGLAAPEX1NPC1RAB9A
SCHEMBL13365129 0.79 CYP4F2 (0.48) TTRGLAL3MBTL1ALDH1A1MAPT
SCHEMBL25275728 0.78 L3MBTL1 (0.73) TTRGLAAPEX1NPC1RAB9A
SCHEMBL19321049 0.78 TTR (0.62) TTRGLAAPEX1NPC1RAB9A
SCHEMBL19326048 0.77 TTR (0.60) TTRGLAAPEX1NPC1RAB9A
SCHEMBL13402279 0.77 APEX1 (1.00) TTRGLAAPEX1NPC1RAB9A
SCHEMBL15878084 0.75 APEX1 (0.58) TTRGLAAPEX1NPC1RAB9A

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-120136764-A Pleuromutilin derivative capable of inhibiting bacterial hydrogen sulfide biosynthesis and preparation method and application thereof 陕西科技大学 2025-06-13 CN disclosed