SCHEMBL31496763

SCHEMBL31496763

Cc1cccc(N[S@+]([O-])C(C)(C)C)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.45
▸ FABP4 P15090 3/20 0.44
▸ FABP3 P05413 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TRPM4 Q8TD43 1/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ AKR1B10 O60218 1/20 0.38
▸ TRPA1 O75762 1/20 0.38
▸ ABCB11 O95342 1/20 0.38
▸ DHFR P00374 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MPO P05164 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38
▸ PTGS1 P23219 1/20 0.38

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
SCHEMBL31496748 0.79 METAP2 (0.39) MEN1KMT2ACYP2C9HPGDPOLB
SCHEMBL31496755 0.76 FABP4 (0.45) KDM4EFABP4FABP3TDP1MEN1
SCHEMBL13034038 0.76 KDM4E (0.50) KDM4EFABP4FABP3TDP1L3MBTL1
SCHEMBL31496759 0.75 ALDH1A1 (0.37) FABP4FABP3MEN1KMT2AALDH1A1
SCHEMBL31496747 0.74 SORT1 (0.36) KDM4EFABP4FABP3MEN1KMT2A
SCHEMBL16318050 0.73 KDM4E (0.54) KDM4EFABP4FABP3TDP1L3MBTL1
SCHEMBL28063083 0.73 KDM4E (0.55) KDM4EFABP4FABP3TDP1L3MBTL1
SCHEMBL28030166 0.72 KDM4E (0.47) KDM4EFABP4FABP3TDP1L3MBTL1
SCHEMBL2624008 0.70 HPGD (0.63) KDM4EFABP4FABP3TDP1L3MBTL1
SCHEMBL355272 0.70 TDP1 (0.61) KDM4EFABP4FABP3TDP1L3MBTL1

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-119661407-A Chiral sulfinamide carboxylic acid compound, and synthetic method and application thereof 浙江大学 2025-03-21 — — CN disclosed
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