SCHEMBL9053601

SCHEMBL9053601

CCc1cc(OCc2ccccc2)ccc1C(CC)(C(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
NR4A2 P43354 3/20 0.47
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
ALOX5 P09917 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
LTB4R Q15722 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.45
PARP10 Q53GL7 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
SRD5A2 P31213 1/20 0.44
FFAR1 O14842 1/20 0.44
PPARG P37231 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL2955611 0.77 LTB4R (0.64) MAOBMEN1KMT2ANR4A2NR4A1
SCHEMBL8070497 0.77 MAOB (0.61) MAOBMEN1KMT2ANR4A2NR4A1
SCHEMBL10891366 0.77 MAOB (0.56) MAOBMEN1KMT2AKDM4EMAPT
SCHEMBL20234843 0.76 MAOB (0.74) MAOBMAPTL3MBTL1LTB4RLTB4R2
SCHEMBL20394187 0.75 ALOX5 (0.54) MAOBMEN1KMT2AALOX5L3MBTL1
SCHEMBL6035603 0.75 MAOB (0.64) MAOBNR4A2NR4A1NR4A3ALOX5
SCHEMBL15935622 0.74 LIPE (0.51) MAOBMEN1KMT2ANR4A2NR4A1
SCHEMBL24159702 0.74 MAOB (0.54) MAOBMEN1KMT2ANR4A2ALOX5
SCHEMBL2133357 0.74 MAOB (0.54) MAOBALOX5L3MBTL1LMNA
SCHEMBL8937667 0.74 MEN1 (0.61) MAOBMEN1KMT2ANR4A2NR4A1

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
EP-0510526-B1 Use of sulfonamides as drug and new sulfonamides HOFFMANN LA ROCHE (CH) 1996-12-04 EP disclosed
EP-0510526-A1 Use of sulfonamides as drug and new sulfonamides F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1992-10-28 EP disclosed