SCHEMBL30153306

SCHEMBL30153306

Cc1oncc1-c1cc(NS(=O)(=O)c2cc(C(=O)O)ccc2C2CC2)c(OC2CC(F)(F)C2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACLY P53396 11/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTK2B Q14289 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RAD52 P43351 1/20 0.34
FABP4 P15090 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL24928850 1.00 ACLY (0.36) ACLYL3MBTL1PTK2BSMN1; SMN2POLB
SCHEMBL31198500 0.91 ACLY (0.38) ACLYL3MBTL1PTK2BSMN1; SMN2POLB
SCHEMBL30153324 0.91 ACLY (0.38) ACLYL3MBTL1PTK2BSMN1; SMN2POLB
SCHEMBL24928651 0.91 ACLY (0.38) ACLYL3MBTL1PTK2BSMN1; SMN2POLB
SCHEMBL24928843 0.91 ACLY (0.38) ACLYL3MBTL1PTK2BSMN1; SMN2POLB
SCHEMBL24928948 0.86 NR1H4 (0.30)
SCHEMBL30845553 0.85 ACLY (0.40) ACLYL3MBTL1SMN1; SMN2TP53ALDH1A1
SCHEMBL30153260 0.85 ACLY (0.40) ACLYL3MBTL1SMN1; SMN2TP53ALDH1A1
SCHEMBL31198427 0.83 ACLY (0.41) ACLYPTK2BSMN1; SMN2RAD52FABP4
SCHEMBL24928655 0.83 ACLY (0.41) ACLYPTK2BSMN1; SMN2RAD52FABP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4376955-A1 PHENYL-SULFAMOYL-BENZOIC ACID DERIVATIVES AS ERAP1- MODULATORS Grey Wolf Therapeutics Limited (GB) 2024-06-05 EP disclosed
CN-117881657-A Phenyl-sulfamoyl-benzoic acid derivatives as ERAP1 modulators 格雷沃尔夫治疗有限公司 2024-04-12 CN disclosed
WO-2023007188-A1 PHENYL-SULFAMOYL-BENZOIC ACID DERIVATIVES AS ERAP1- MODULATORS Grey Wolf Therapeutics Limited (GB) 2023-02-02 WO disclosed