SCHEMBL496058

SCHEMBL496058

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

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 4/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
LMNA P02545 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
OPRK1 P41145 2/20 0.39
OPRM1 P35372 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAD52 P43351 1/20 0.39
GFER P55789 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
SCHEMBL495858 0.87 MAPK1 (0.44) ALOX15MAPK1TDP1ALDH1A1KDM4E
SCHEMBL495986 0.84 SMN1; SMN2 (0.56) MAPK1ALDH1A1KMT2ASIGMAR1L3MBTL1
SCHEMBL10129614 0.76 NR2F2 (0.40) MAPK1ALDH1A1KDM4EKMT2ASIGMAR1
SCHEMBL10940783 0.71 CHRNB2 (0.42) ALOX15MAPK1ALDH1A1KMT2ALMNA
SCHEMBL495996 0.69 SIGMAR1 (0.48) ALDH1A1KDM4EKMT2ASIGMAR1
SCHEMBL496251 0.69 SIGMAR1 (0.48) ALDH1A1KDM4EKMT2ASIGMAR1
SCHEMBL495820 0.69 SIGMAR1 (0.41) TDP1SIGMAR1
SCHEMBL2132644 0.69 ALDH1A1 (0.64) ALOX15MAPK1ALDH1A1KDM4EKMT2A
SCHEMBL29375324 0.69 ALDH1A1 (0.64) ALOX15MAPK1ALDH1A1KDM4EKMT2A
SCHEMBL2888716 0.67 TSHR (0.60) ALOX15MAPK1ALDH1A1KDM4EKMT2A

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 ALOX15 699/4885MAPK1 1633/4885TDP1 2716/4885

“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.