SCHEMBL6355022

SCHEMBL6355022

O=C(NCc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.53
PPARG P37231 2/20 0.52
PTGES O14684 7/20 0.52
CCR1 P32246 1/20 0.52
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
NTRK1 P04629 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
P2RX7 Q99572 4/20 0.49

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
SCHEMBL6355300 0.89 EPHX2 (0.55) EPHX2PPARGNTRK1HDAC3HDAC1
SCHEMBL6356836 0.88 KDM4E (0.52) EPHX2PPARGCCR1LMNAGAA
SCHEMBL6357056 0.88 EPHX2 (0.49) EPHX2PTGESCCR1LMNAGAA
SCHEMBL6362493 0.84 P2RX7 (0.49) EPHX2PPARGCCR1LMNANTRK1
SCHEMBL6357231 0.82 EPHX2 (0.57) EPHX2PPARGP2RX7
SCHEMBL1380047 0.80 P2RX7 (0.48) EPHX2PPARGCCR1NTRK1HDAC3
SCHEMBL6356880 0.80 HPGD (0.56) EPHX2PPARGLMNAHDAC3HDAC1
SCHEMBL5723612 0.79 P2RX7 (0.57) EPHX2PPARGNTRK1HDAC3HDAC1
SCHEMBL26715334 0.78 PTGES (0.59) EPHX2PPARGPTGESCCR1NTRK1
SCHEMBL6361826 0.77 P2RX7 (0.51) EPHX2LMNAHDAC1HDAC6P2RX7

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 EPHX2 4047/4885PPARG 50/4885PTGES 717/4885

“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.