SCHEMBL6359727

SCHEMBL6359727

CC(NC(=O)c1ccccc1Cl)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 3/20 0.74
ALDH1A1 P00352 6/20 0.69
KDM4E B2RXH2 3/20 0.69
HPGD P15428 3/20 0.69
HSD17B10 Q99714 2/20 0.69
LMNA P02545 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.64
NPC1 O15118 2/20 0.61
RAB9A P51151 1/20 0.61
BDKRB1 P46663 1/20 0.60
POLB P06746 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
MAPK8 P45983 1/20 0.53

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
SCHEMBL6355765 0.89 GPR139 (0.74) GPR139ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL5642490 0.89 SMN1; SMN2 (0.64) GPR139ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2406807 0.85 SMN1; SMN2 (0.60) GPR139ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL743064 0.83 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL1285890 0.83 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL1285869 0.83 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL4804043 0.83 NPC1 (0.57) GPR139ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL5451054 0.82 POLB (0.62) GPR139ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL1321211 0.82 SMN1; SMN2 (0.67) GPR139ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8297129 0.81 POLB (0.56) GPR139ALDH1A1KDM4EHPGDHSD17B10

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-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-13 US claimed
EP-1438973-A1 REMEDIES FOR STRESS DISEASES COMPRISING MITOCHONDRIAL BENZODIAZEPINE RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2004-07-21 EP claimed
US-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 2005-01-13 US disclosed
EP-1438973-A1 REMEDIES FOR STRESS DISEASES COMPRISING MITOCHONDRIAL BENZODIAZEPINE RECEPTOR ANTAGONISTS ONO PHARMACEUTICAL CO., LTD. (JP) 2004-07-21 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-20050009812-A1 Remedies for stress diseases comprising mitochondrial benzodiazepine receptor antagonists TFAM, CYP11B2, CYP11B1 GPR139 536/4885ALDH1A1 1194/4885KDM4E 3232/4885

“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.