SCHEMBL31311292

SCHEMBL31311292

COc1cccc(CNc2cnc(S(=O)(=O)Nc3nc(-c4ccc(F)c(F)c4)c(Br)s3)c(C)c2)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 18/20 0.51
ALOX15 P16050 5/20 0.51
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
MAPK1 P28482 1/20 0.46
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
NFKB1 P19838 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL31311240 0.94 ALOX12 (0.49) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311191 0.94 ALOX15 (0.51) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL25235861 0.92 ALOX12 (0.53) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311215 0.92 ALOX12 (0.57) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL30464958 0.92 ALOX12 (0.53) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311162 0.91 ALOX12 (0.51) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311333 0.90 ALOX12 (0.54) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311203 0.89 ALOX12 (0.49) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311235 0.89 ALOX12 (0.49) ALOX12ALOX15ALDH1A1LMNAGAA
SCHEMBL31311365 0.88 ALOX12 (0.52) ALOX12ALOX15ALDH1A1LMNAGAA

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-4731206-A2 COMPOSITIONS AND METHODS OF USE TO TREAT 12-LIPOXYGENASE (12-LOX) MEDIATED DISEASES Veralox Therapeutics Inc. (US) 2026-04-29 EP disclosed
WO-2024264032-A2 COMPOSITIONS AND METHODS OF USE TO TREAT 12-LIPOXYGENASE (12-LOX) MEDIATED DISEASES VERALOX THERAPEUTICS INC. (US) 2024-12-26 WO disclosed