Benzoylpas

Benzoylpas

SCHEMBL9770542

O=C(Nc1ccc(C(=O)O)c(O)c1)c1ccccc1.[CaH2]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.97
PKM P14618 2/20 0.97
MAPT P10636 2/20 0.68
KDM4E B2RXH2 2/20 0.68
MAPK1 P28482 1/20 0.68
SIRT6 Q8N6T7 1/20 0.65
KCNK3 O14649 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59
ALOX15 P16050 1/20 0.56
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
PTPN1 P18031 1/20 0.54
MEN1 O00255 3/20 0.54
GRIK1 P39086 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
SIRT1 Q96EB6 2/20 0.53
POLB P06746 1/20 0.53
FFAR1 O14842 1/20 0.53
ACE2 Q9BYF1 1/20 0.53

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
Benzoylpas SCHEMBL563122 0.98 KMT2A (1.00) KMT2APKMMAPTKDM4EMAPK1
Benzoylpas SCHEMBL29353120 0.97 KMT2A (0.97) KMT2APKMMAPTKDM4EMAPK1
Benzoylpas SCHEMBL8748163 0.97 KMT2A (0.97) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL27296254 0.92 KMT2A (0.87) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL30772317 0.92 KMT2A (0.87) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL3296397 0.89 KMT2A (0.83) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL13187383 0.86 KMT2A (0.78) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL1129948 0.85 KMT2A (0.77) KMT2APKMMAPTKDM4EMAPK1
SCHEMBL11593167 0.85 KMT2A (0.76) KMT2APKMMAPTKDM4EKCNK3
Benzoylpas SCHEMBL1649155 0.84 KMT2A (0.75) KMT2APKMMAPTKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0046270-B1 NOVEL DERIVATIVES OF BIO-AFFECTING PHENOLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITION CONTAINING THEM INTERx RESEARCH CORPORATION (US) 1986-05-21 EP claimed
EP-0046270-A1 Novel derivatives of bio-affecting phenolic compounds and pharmaceutical composition containing them INTERx RESEARCH CORPORATION (US) 1982-02-24 EP claimed
US-5001115-A Prodrugs of biologically active hydroxyaromatic compounds UNIVERSITY OF FLORIDA (US) 1991-03-19 US disclosed
EP-0046270-A1 Novel derivatives of bio-affecting phenolic compounds and pharmaceutical composition containing them INTERx RESEARCH CORPORATION (US) 1982-02-24 EP disclosed