SCHEMBL31487802

SCHEMBL31487802

COC(=O)c1ccc(Cl)c(C(=O)O)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.58
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 1/20 0.51
ABL1 P00519 1/20 0.44
LMNA P02545 3/20 0.43
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA7 P43166 3/20 0.43
CA9 Q16790 3/20 0.43
CA14 Q9ULX7 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PDK2 Q15119 1/20 0.43
PDK4 Q16654 1/20 0.43
NR4A2 P43354 3/20 0.42
MAPT P10636 2/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL7171964 0.84 ALDH1A1 (0.53) DPP4KDM4EALDH1A1HSD17B10ABL1
SCHEMBL31487975 0.83 ABL1 (0.41) DPP4KDM4EALDH1A1HSD17B10ABL1
Hydrochloric Acid SCHEMBL8306764 0.83 ALDH1A1 (0.51) DPP4KDM4EALDH1A1HSD17B10ABL1
SCHEMBL27777851 0.82 CA12 (0.52) KDM4EHSD17B10LMNACA12CA1
SCHEMBL31083244 0.82 CA12 (0.52) KDM4EHSD17B10LMNACA12CA1
SCHEMBL14699891 0.82 ABL1 (0.49) KDM4EALDH1A1HSD17B10ABL1LMNA
SCHEMBL16702234 0.80 ALDH1A1 (0.60) DPP4KDM4EALDH1A1HSD17B10LMNA
SCHEMBL15903090 0.79 SORT1 (0.50) DPP4KDM4EALDH1A1HSD17B10ABL1
SCHEMBL16702753 0.78 ALDH1A1 (0.58) DPP4KDM4EALDH1A1HSD17B10LMNA
SCHEMBL3181067 0.77 SELL (0.56) KDM4EALDH1A1HSD17B10ABL1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119462555-A Sulfonamide compound and application thereof 上海科技大学 2025-02-18 CN disclosed
WO-2025031360-A1 SULFONAMIDE COMPOUND AND USE THEREOF 上海科技大学 2025-02-13 WO disclosed