SCHEMBL11588024

SCHEMBL11588024

O=C(Nc1ccc(O)cc1O)c1cc(Cl)c(O)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B13 Q7Z5P4 1/20 0.48
TOP1 P11387 2/20 0.47
TOP2A P11388 2/20 0.47
TOP2B Q02880 2/20 0.47
STK39 Q9UEW8 1/20 0.46
CXCR1 P25024 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SNCA P37840 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
AKR1C4 P17516 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
AKR1C1 Q04828 1/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 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
SCHEMBL11590152 0.84 KCNMA1 (0.51) HSD17B13TOP1TOP2ATOP2BSNCA
SCHEMBL11589177 0.84 RAB9A (0.57) HSD17B13MEN1KMT2ANPC1RAB9A
SCHEMBL11588151 0.82 NPC1 (0.66) HSD17B13TOP1TOP2ATOP2BMEN1
SCHEMBL10011045 0.78 KCNMA1 (0.57) TOP1TOP2ATOP2BCXCR1MEN1
SCHEMBL12431978 0.78 MEN1 (0.59) TOP1CXCR1MEN1KMT2ANPC1
SCHEMBL21462534 0.76 MDM4 (0.57) MEN1KMT2ANPC1TP53RAB9A
SCHEMBL27851528 0.75 MAPT (0.51) TOP1CXCR1MEN1KMT2ASNCA
SCHEMBL11589160 0.75 KCNMA1 (0.62) HSD17B13TOP1TOP2ATOP2BSNCA
SCHEMBL25349072 0.73 RAB9A (0.64) HSD17B13TOP1TOP2ATOP2BMEN1
SCHEMBL28463141 0.73 TP53 (0.65) HSD17B13TOP1TOP2ATOP2BMEN1

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
US-4091097-A A 2'-HYDROXY-3-CARBOXY-4,5-SUBSTITUTED-BENZANILIDE, ITS ESTERS AND SALTS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) 1978-05-23 US disclosed
US-4024253-A BENZANILIDE DERIVATIVES ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JA) 1977-05-17 US disclosed