SCHEMBL495986

SCHEMBL495986

CCOC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CCCC[C@@H]1N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
ALDH1A1 P00352 7/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
SIGMAR1 Q99720 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CASP3 P42574 1/20 0.44
FKBP1A P62942 1/20 0.43
MAPK1 P28482 1/20 0.41

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
SCHEMBL496058 0.84 ALOX15 (0.45) ALDH1A1KMT2ASIGMAR1L3MBTL1MAPK1
SCHEMBL495858 0.84 MAPK1 (0.44) SMN1; SMN2ALDH1A1KMT2ATP53MAPT
SCHEMBL591468 0.76 SMN1; SMN2 (0.61) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL6171928 0.75 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL6941197 0.75 MAPT (0.62) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL6581538 0.75 SMN1; SMN2 (0.76) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL10129614 0.73 NR2F2 (0.40) ALDH1A1KMT2AMEN1MAPTSIGMAR1
SCHEMBL7997377 0.73 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL6576971 0.71 SMN1; SMN2 (0.74) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL8004123 0.71 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1KMT2AMEN1TP53

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-1955697-B1 2-AMINOBENZAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) INHIBITORS USEFUL FOR THE TREATMENT OF PAIN OR BLADDER FUNCTION DISORDER ASTELLAS PHARMA INC (JP) 2012-05-02 EP disclosed
US-8106190-B2 2-aminobenzamide derivatives ASTELLAS PHARMA INC. (JP) 2012-01-31 US disclosed
US-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-09-17 US disclosed
EP-1955697-A1 2-AMINOBENZAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-08-13 EP 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-20090233900-A1 2-AMINOBENZAMIDE DERIVATIVE TRPV1, TRPV2, TRPV5 SMN1; SMN2 1960/4885ALDH1A1 1210/4885KMT2A 2104/4885

“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.