SCHEMBL31435348

SCHEMBL31435348

CCCc1ccc(C(=O)OC)c(SC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.42
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
MAPK1 P28482 1/20 0.42
MAPT P10636 5/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 3/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL20556212 0.89 PPARA (0.54) SMN1; SMN2MAPTPPARGPPARAPLK1
SCHEMBL7575696 0.83 MAPT (0.43) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL26270868 0.82 MAPT (0.51) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL15498466 0.80 KDM4E (0.45) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL8303432 0.80 CA12 (0.59) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL8338463 0.78 NPC1 (0.58) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL465065 0.78 PPARG (0.58) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL7219535 0.78 NPC1 (0.44) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL28280175 0.78 ALDH1A1 (0.58) SMN1; SMN2NPC1RAB9AMAPK1MAPT
SCHEMBL3557705 0.78 MEN1 (0.41) MAPK1TSHRHPGDTDP1PPARG

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-2025090792-A1 AMIDE PRODRUGS AND USES THEREOF AUTOBAHN THERAPEUTICS, INC. (US) 2025-05-01 WO disclosed