SCHEMBL6358887

SCHEMBL6358887

Cc1cccc(C)c1CNC(=O)c1ccccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.55
ALDH1A1 P00352 3/20 0.55
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
GPR139 Q6DWJ6 1/20 0.51
KMT2A Q03164 2/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
RECQL P46063 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPK1 P28482 1/20 0.49
MT-CO2 P00403 2/20 0.48

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
SCHEMBL5645103 0.89 HPGD (0.62) HPGDALDH1A1CYP1A2POLBNPC1
SCHEMBL6355044 0.84 HPGD (0.77) HPGDALDH1A1CYP1A2NPC1RAB9A
SCHEMBL6362518 0.81 ATM (0.58) HPGDALDH1A1NPC1RAB9AKMT2A
SCHEMBL23083253 0.81 GAA (0.57) HPGDALDH1A1POLBNPC1RAB9A
SCHEMBL5645352 0.81 HPGD (0.55) HPGDALDH1A1CYP1A2POLBNPC1
SCHEMBL5645008 0.81 HPGD (0.57) HPGDALDH1A1CYP1A2POLBNPC1
SCHEMBL6357738 0.80 ATM (0.56) HPGDALDH1A1CYP1A2POLBNPC1
SCHEMBL15686093 0.78 HPGD (0.68) HPGDALDH1A1NPC1RAB9AKMT2A
SCHEMBL5860823 0.77 NPC1 (0.71) HPGDALDH1A1CYP1A2POLBNPC1
SCHEMBL4148749 0.76 HPGD (0.70) HPGDALDH1A1CYP1A2POLBNPC1

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 HPGD 586/4885ALDH1A1 1194/4885CYP1A2 285/4885

“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.