SCHEMBL3586994

SCHEMBL3586994

CCC(COCc1ccccc1)Oc1cc(Br)cc(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NR4A2 P43354 2/20 0.42
MRGPRX4 Q96LA9 2/20 0.41
NR4A1 P22736 1/20 0.39
NR4A3 Q92570 1/20 0.39
SRD5A2 P31213 1/20 0.38
CA1 P00915 2/20 0.38
GCK P35557 1/20 0.38
MAOB P27338 1/20 0.38
PTGER1 P34995 1/20 0.38
TACR1 P25103 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
SCHEMBL3588948 0.87 MEN1 (0.48) MEN1KMT2ANR4A2MRGPRX4NR4A1
SCHEMBL3598854 0.82 MAOB (0.39) CA1MAOBTACR1
SCHEMBL3605126 0.81 PLA2G2A (0.40) MEN1KMT2AGCK
SCHEMBL20259514 0.80 MAOB (0.46) CA1MAOBTACR1
SCHEMBL3607194 0.80 KMT2A (0.35) MEN1KMT2AMRGPRX4
SCHEMBL3605804 0.80 PLA2G2A (0.35) MEN1KMT2A
SCHEMBL1427178 0.79 MEN1 (0.64) MEN1KMT2ANR4A2MRGPRX4NR4A1
SCHEMBL3603264 0.78 PLA2G2A (0.35) MEN1KMT2AMRGPRX4
SCHEMBL14251338 0.76 MEN1 (0.79) MEN1KMT2ANR4A2MRGPRX4NR4A1
SCHEMBL5184267 0.75 KMT2A (0.58) MEN1KMT2ANR4A2MRGPRX4NR4A1

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 MEN1 2346/4885KMT2A 726/4885NR4A2 2786/4885

“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.