SCHEMBL2598686

SCHEMBL2598686

CN(C)C(=O)c1cc(CC(=O)O)ccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 1/20 0.44
CYP1A2 P05177 1/20 0.42
HKDC1 Q2TB90 1/20 0.41
DTYMK P23919 1/20 0.40
GSTP1 P09211 1/20 0.40
GSTM2 P28161 1/20 0.40
TSHR P16473 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
NFKB1 P19838 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
RGS12 O14924 1/20 0.39

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
SCHEMBL2597757 1.00 HPGD (0.46) HPGDKMT2AMEN1NPSR1L3MBTL1
SCHEMBL3726231 0.85 PDGFRB (0.45) HPGDKMT2AMEN1NPSR1L3MBTL1
SCHEMBL3735227 0.84 KMT2A (0.47) HPGDKMT2AMEN1NPSR1L3MBTL1
SCHEMBL402632 0.84 L3MBTL1 (0.44) HPGDKMT2AMEN1NPSR1L3MBTL1
SCHEMBL7649559 0.83 DTYMK (0.57) HPGDKMT2AMEN1CYP1A2DTYMK
SCHEMBL7655467 0.80 SIRT6 (0.51) HPGDKMT2AMEN1L3MBTL1CYP1A2
SCHEMBL1865824 0.78 CASP6 (0.55) HPGDKMT2AMEN1HTTCYP1A2
SCHEMBL14777639 0.77 TSHR (0.58) HPGDKMT2AMEN1L3MBTL1CYP1A2
SCHEMBL3729240 0.77 TSHR (0.55) HPGDKMT2AMEN1NPSR1L3MBTL1
SCHEMBL1857955 0.77 ALDH1A1 (0.53) HPGDKMT2AMEN1NPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571860-A1 2-PHENYL BENZOYLAMIDES Pfizer Inc (US) 2013-03-27 EP disclosed
US-20130072519-A1 2-PHENYL BENZOYLAMIDES CONN EDWARD LEE (US) 2013-03-21 US disclosed
WO-2011145022-A1 2-PHENYL BENZOYLAMIDES PFIZER INC. (US) 2011-11-24 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-20130072519-A1 2-PHENYL BENZOYLAMIDES APOB, MTTP, HADHB HPGD 959/4885KMT2A 2718/4885MEN1 4527/4885

“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.