SCHEMBL1716718

SCHEMBL1716718

CC1CN(Cc2ccccc2)CC1c1nc2c(cnn2C2CCOCC2)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 20/20 1.00
PDE1C Q14123 16/20 1.00
PDE1A P54750 1/20 0.78
PDE1B Q01064 1/20 0.78
HDAC1 Q13547 2/20 0.78
HDAC2 Q92769 2/20 0.78
HDAC6 Q9UBN7 2/20 0.78

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
SCHEMBL1716748 1.00 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL1717044 0.92 PDE9A (1.00) PDE9APDE1CHDAC1HDAC2HDAC6
SCHEMBL15996122 0.92 PDE9A (1.00) PDE9APDE1CHDAC1HDAC2HDAC6
SCHEMBL12572133 0.92 PDE9A (0.96) PDE9APDE1CHDAC1HDAC2HDAC6
SCHEMBL1716551 0.91 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL17390226 0.91 PDE9A (0.85) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL1717521 0.90 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL30947582 0.90 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL3727052 0.90 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1
SCHEMBL1716516 0.90 PDE9A (1.00) PDE9APDE1CPDE1APDE1BHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024107445-A1 ENHANCEMENT OF THE EFFICACY OF SEROTONERGIC PSYCHEDELIC DRUGS IN THE TREATMENT OR PREVENTION OF CERTAIN NEUROPSYCHIATRIC DISORDERS THROUGH INHIBITION OF TYPE-9 PHOSPHODIESTERASES FREEDOM BIOSCIENCES, INC. (US) 2024-05-23 WO disclosed
EP-2961741-B1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES FUND PARA LA INVESTIG MEDICA APLICADA (ES) 2017-04-05 EP disclosed
US-9573956-B2 Compounds as dual inhibitors of phosphodiesterases and histone deacetylases FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2017-02-21 US disclosed
US-20160002246-A1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES FUNDACIÓN PARA LA INVESTIGACIÓN MÉDICA APLICADA (ES) 2016-01-07 US disclosed
EP-2152712-B1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER (US) 2012-01-11 EP disclosed
US-7964607-B2 Pyrazolo[3,4-d]pyrimidine compounds PFIZER INC. (US) 2011-06-21 US disclosed
EP-2152712-A1 AMINO-HETEROCYCLIC COMPOUNDS Pfizer Inc. (US) 2010-02-17 EP disclosed
US-20090030003-A1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER INC 2009-01-29 US disclosed
WO-2008139293-A1 AMINO-HETEROCYCLIC COMPOUNDS PFIZER INC. (US) 2008-11-20 WO 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 (2 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-20090030003-A1 AMINO-HETEROCYCLIC COMPOUNDS PDE9A, PDE2A, PDE10A PDE9A 1/4885PDE1C 29/4885PDE1A 26/4885
US-20160002246-A1 NOVEL COMPOUNDS AS DUAL INHIBITORS OF PHOSPHODIESTERASES AND HISTONE DEACETYLASES PDE1A, HDAC1, HDAC2 PDE9A 33/4885PDE1C 5/4885PDE1A 1/4885

“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.