SCHEMBL30837941

SCHEMBL30837941

COc1ccc(Cn2c(=O)c3cc(OC(CF)CF)ccc3n(C3CCN(C=O)CC3)c2=O)cc1O

nearest known ligand 0.87

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 10/20 0.87
▸ PDE7B Q9NP56 5/20 0.87
▸ PDE8A O60658 3/20 0.87
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ OPRL1 P41146 6/20 0.36
▸ OPRM1 P35372 5/20 0.36
▸ OPRD1 P41143 2/20 0.34

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
SCHEMBL100710 1.00 PDE7A (0.87) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL100865 0.94 PDE7A (0.87) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL100704 0.93 PDE7A (1.00) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL30837881 0.93 PDE7A (1.00) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL30837816 0.92 PDE7A (0.88) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL30837836 0.92 PDE7A (0.88) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL99882 0.92 PDE7A (0.88) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL100723 0.92 PDE7A (0.88) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL100239 0.91 PDE7A (0.93) PDE7APDE7BPDE8AMAPTMEN1
SCHEMBL100878 0.91 PDE7A (0.93) PDE7APDE7BPDE8AMAPTMEN1

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
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