SCHEMBL30837872

SCHEMBL30837872

COc1cc(Cn2c(=O)c3cc(OC(CF)CF)ccc3n(C3CCN(C=O)CC3)c2=O)ccc1C

nearest known ligand 0.88

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 10/20 0.88
PDE7B Q9NP56 5/20 0.88
PDE8A O60658 3/20 0.88
OPRM1 P35372 10/20 0.41
OPRL1 P41146 10/20 0.41
OPRD1 P41143 4/20 0.39

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
SCHEMBL100771 1.00 PDE7A (0.88) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL30837836 0.94 PDE7A (0.88) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL99882 0.94 PDE7A (0.88) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL30837881 0.94 PDE7A (1.00) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL100704 0.94 PDE7A (1.00) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL99921 0.92 PDE7A (0.88) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL100878 0.92 PDE7A (0.93) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL100865 0.92 PDE7A (0.87) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL30837796 0.92 PDE7A (0.93) PDE7APDE7BPDE8AOPRM1OPRL1
SCHEMBL30837943 0.92 PDE7A (0.93) PDE7APDE7BPDE8AOPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4572765-A1 USE OF A THERAPEUTIC AGENT WITH PHOSPHODIESTERASE-7 INHIBITORY ACTIVITY FOR THE TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH CHRONIC FATIGUE, EXHAUSTION AND/OR EXERTIONAL INTOLERANCE Mitodicure GmbH (DE) 2025-06-25 EP disclosed
WO-2024038089-A1 USE OF A THERAPEUTIC AGENT WITH PHOSPHODIESTERASE-7 INHIBITORY ACTIVITY FOR THE TREATMENT AND PREVENTION OF DISEASES ASSOCIATED WITH CHRONIC FATIGUE, EXHAUSTION AND/OR EXERTIONAL INTOLERANCE MITODICURE GMBH (DE) 2024-02-22 WO disclosed