SCHEMBL3592397

SCHEMBL3592397

CCC(COC1CCCCO1)Oc1cc(Br)cc(C(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
CREBBP Q92793 2/20 0.39
EP300 Q09472 1/20 0.37
GCK P35557 2/20 0.36
PTGER4 P35408 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
PLA2G2A P14555 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL3601973 0.88 KMT2A (0.46) KMT2AMEN1CREBBPEP300GCK
SCHEMBL3607258 0.83 GCK (0.34) KMT2AMEN1GCKKDM4CNPC1
SCHEMBL3605126 0.76 PLA2G2A (0.40) KMT2AMEN1GCKPLA2G2A
SCHEMBL3603264 0.75 PLA2G2A (0.35) KMT2AMEN1PLA2G2ANPC1RAB9A
SCHEMBL3601976 0.75 KMT2A (0.41) KMT2AMEN1CREBBPEP300PTGER4
SCHEMBL3592401 0.74 KMT2A (0.42) KMT2AMEN1CREBBPEP300PTGER4
SCHEMBL3607194 0.70 KMT2A (0.35) KMT2AMEN1NPC1RAB9A
SCHEMBL14281436 0.70 KMT2A (0.67) KMT2AMEN1CREBBPEP300GCK
SCHEMBL3600890 0.70 GCK (0.42) KMT2AMEN1GCKKDM4CNPC1
SCHEMBL3605804 0.70 PLA2G2A (0.35) KMT2AMEN1PLA2G2ANPC1RAB9A

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
US-7700640-B2 Process for making phenoxy benzamide compounds ASTRAZENECA AB (SE) 2010-04-20 US disclosed
US-20080200694-A1 Process for Making Phenoxy Benzamide Compounds ASTRAZENECA AB (SE) 2008-08-21 US disclosed
EP-1802570-A1 PROCESS FOR MAKING PHENOXY BENZAMIDE COMPOUNDS AstraZeneca AB (SE) 2007-07-04 EP disclosed
WO-2006040527-A1 PROCESS FOR MAKING PHENOXY BENZAMIDE COMPOUNDS ASTRAZENECA AB (SE) 2006-04-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080200694-A1 Process for Making Phenoxy Benzamide Compounds PAH, MAOB, TYR KMT2A 726/4885MEN1 2346/4885CREBBP 390/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.