SCHEMBL4770722

SCHEMBL4770722

O=C(O)c1cnn(-c2ccccc2)c1-n1cccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 1.00
SMN1; SMN2 Q16637 5/20 0.72
ALDH1A1 P00352 4/20 0.72
GAA P10253 4/20 0.61
MAPT P10636 6/20 0.58
TP53 P04637 3/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
NPSR1 Q6W5P4 2/20 0.56
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
POLB P06746 2/20 0.55
NR4A3 Q92570 1/20 0.55
THRB P10828 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55

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
SCHEMBL3068285 0.78 L3MBTL1 (0.64) L3MBTL1SMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL3063443 0.77 L3MBTL1 (0.62) L3MBTL1SMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL10998196 0.76 POLB (0.61) L3MBTL1SMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL70175 0.76 POLB (0.61) L3MBTL1SMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL15333366 0.76 SMN1; SMN2 (0.76) L3MBTL1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL1192831 0.76 L3MBTL1 (0.60) L3MBTL1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL3081183 0.75 L3MBTL1 (0.59) L3MBTL1SMN1; SMN2ALDH1A1MAPTTP53
SCHEMBL2853100 0.75 POLB (0.64) L3MBTL1SMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL1335080 0.75 RIPK2 (0.78) L3MBTL1SMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL1406875 0.75 L3MBTL1 (0.59) L3MBTL1SMN1; SMN2ALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2842939-B1 BENZAMIDE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-05-30 EP disclosed
US-9695118-B2 Benzamide derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2017-07-04 US disclosed
US-20150152047-A1 BENZAMIDE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-06-04 US disclosed
EP-2842939-A1 BENZAMIDE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2015-03-04 EP disclosed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 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-20150152047-A1 BENZAMIDE DERIVATIVE CYP3A5, HDAC6, BRD1 L3MBTL1 3715/4885SMN1; SMN2 2867/4885ALDH1A1 56/4885

“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.