SCHEMBL24424558

SCHEMBL24424558

Cc1ccc(SOCC2(COS(=O)(=O)c3ccc(C)cc3)CC(O)(C(F)(F)F)C2)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
STAT3 P40763 1/20 0.32
DNMT1 P26358 1/20 0.31
BCHE P06276 2/20 0.31
ACHE P22303 2/20 0.31
NPSR1 Q6W5P4 2/20 0.30
MAPT P10636 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL24424556 0.89 STAT3 (0.38) SMN1; SMN2ALDH1A1LMNANPC1RAB9A
SCHEMBL19905723 0.81 DNMT1 (0.34) SMN1; SMN2ALDH1A1LMNAHTTSTAT3
SCHEMBL18047923 0.69 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1STAT3
SCHEMBL13453046 0.69 STAT3 (0.38) SMN1; SMN2ALDH1A1LMNAHTTSTAT3
SCHEMBL17049 0.69 KMT2A (0.40) SMN1; SMN2ALDH1A1STAT3DNMT1BCHE
SCHEMBL25487728 0.68 STAT3 (0.39) SMN1; SMN2ALDH1A1LMNAHTTRAB9A
SCHEMBL29906344 0.68 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1LMNAHTTSTAT3
SCHEMBL24424690 0.67 NPC1 (0.34) SMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL7949968 0.67 CYP2D6 (0.41) SMN1; SMN2ALDH1A1STAT3ACHE
SCHEMBL17869 0.67 KMT2A (0.41) SMN1; SMN2ALDH1A1LMNAHTTSTAT3

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-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 WO disclosed