SCHEMBL6355356

SCHEMBL6355356

Cc1cc(Cn2nnnc2-c2ccncc2)c(C)cc1O

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.64
P2RX7 Q99572 9/20 0.53
ALDH1A1 P00352 3/20 0.36
MAPK10 P53779 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD11B1 P28845 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL6356146 0.86 POLB (0.47) POLBP2RX7ALDH1A1HDAC6HPGD
SCHEMBL6352713 0.78 POLB (1.00) POLBP2RX7ALDH1A1MAPK10HDAC6
SCHEMBL12761227 0.72 P2RX7 (0.61) POLBP2RX7ALDH1A1MAPK10HDAC6
SCHEMBL6362310 0.71 P2RX7 (0.69) POLBP2RX7ALDH1A1L3MBTL1
SCHEMBL6848477 0.69 P2RX7 (0.54) POLBP2RX7ALDH1A1HDAC6HPGD
SCHEMBL5799401 0.66 P2RX7 (0.65) POLBP2RX7ALDH1A1MEN1CYP1A2
SCHEMBL6357253 0.66 POLB (0.78) POLBP2RX7ALDH1A1HDAC6HTT
SCHEMBL6355395 0.64 POLB (0.74) POLBP2RX7ALDH1A1HDAC6HPGD
SCHEMBL6362432 0.64 POLB (0.74) POLBP2RX7ALDH1A1HDAC6HTT
SCHEMBL22322904 0.63 SMN1; SMN2 (0.53) POLBP2RX7ALDH1A1MAPK10HPGD

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 POLB 1411/4885P2RX7 448/4885ALDH1A1 1194/4885

“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.