SCHEMBL31752771

SCHEMBL31752771

CCCCCc1c(Br)c(O)c(Br)c(O)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.41
TYR P14679 1/20 0.40
PTGS2 P35354 4/20 0.39
CYP3A4 P08684 2/20 0.39
CYP19A1 P11511 1/20 0.38
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
SHBG P04278 1/20 0.38
TP53 P04637 1/20 0.38
HSPD1 P10809 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
SCHEMBL9752849 0.86 ALOX5 (0.44) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5587858 0.83 CYP19A1 (0.40) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5586843 0.81 ALOX5 (0.41) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5590472 0.81 ALOX5 (0.41) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5587338 0.81 ALOX5 (0.41) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5587950 0.81 ALOX5 (0.41) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5589507 0.81 ALOX5 (0.41) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5587877 0.78 CA1 (0.43) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL5589845 0.78 CA1 (0.43) ALOX5TYRPTGS2CYP3A4CYP19A1
SCHEMBL18371600 0.78 CYP19A1 (0.51) ALOX5TYRPTGS2CYP3A4CYP19A1

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
WO-2025262615-A1 ANTIOXIDANTS CONTAINING DIAZIRINE FUNCTIONALITIES, COMPOSITIONS COMPRISING THEM AND USE THEREOF BELLARE ANUJ (US) 2025-12-26 WO claimed
WO-2025262615-A1 ANTIOXIDANTS CONTAINING DIAZIRINE FUNCTIONALITIES, COMPOSITIONS COMPRISING THEM AND USE THEREOF BELLARE ANUJ (US) 2025-12-26 WO disclosed