SCHEMBL64217

SCHEMBL64217

O=C(O)NC1COC(=O)C1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
MTNR1A P48039 2/20 0.35
PDE5A O76074 1/20 0.31
GAA P10253 1/20 0.30
PDCD1 Q15116 2/20 0.30
CD274 Q9NZQ7 2/20 0.30

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
SCHEMBL3861339 1.00 HTT (0.39) HTTMTNR1APDE5AGAAPDCD1
SCHEMBL1504120 1.00 HTT (0.39) HTTMTNR1APDE5AGAAPDCD1
SCHEMBL1379501 0.82 MTNR1A (0.51) HTTMTNR1APDE5A
SCHEMBL1379498 0.82 MTNR1A (0.51) HTTMTNR1APDE5A
SCHEMBL17292437 0.80 LMNA (0.32) HTT
SCHEMBL17224233 0.80 LMNA (0.32) HTT
SCHEMBL15591379 0.78 NR1I2 (0.31) MTNR1A
SCHEMBL20464506 0.77 ALDH1A1 (0.39) HTTMTNR1AGAA
SCHEMBL15820269 0.76
SCHEMBL3307631 0.76 GAA (0.53) GAA

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4392397-A2 PROCESS OF MAKING APOPTOSIS-INDUCING AGENTS AbbVie Inc. (US) 2024-07-03 EP disclosed
WO-2023028558-A2 PROCESS OF MAKING APOPTOSIS-INDUCING AGENTS ABBVIE INC. (US) 2023-03-02 WO disclosed
US-20230020952-A1 MACROCYCLES COMPRISING A 4-AMIDO-2,4-PENTADIENOATE MOIETY FOR THE TREATMENT OF HYPOXIC CANCERS AARHUS UNIVERSITET (DK) 2023-01-19 US disclosed
WO-2021110968-A1 MACROCYLCES COMPRISING A 4-AMIDO-2,4-PENTADIENOATE MOIETY FOR THE TREATMENT OF HYPOXIC CANCERS AARHUS UNIVERSITET (DK) 2021-06-10 WO disclosed
EP-2601177-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (SE) 2017-10-18 EP disclosed
US-20160176906-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-06-23 US disclosed
US-9248140-B2 Chemical compounds ASTRAZENECA AB (SE) 2016-02-02 US disclosed
US-20150328239-A1 Chemical Compounds ASTRAZENECA AB (SE) 2015-11-19 US disclosed
US-9018381-B2 Chemical compounds ASTRAZENECA AB (SE) 2015-04-28 US disclosed
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ASTRAZENECA AB (UK) 2013-11-21 US disclosed
EP-2223923-A1 Process for the preparation of a chiral beta aminoacid derivative and intermediates thereof Esteve Química, S.A. (ES) 2010-09-01 EP disclosed
US-7615549-B2 Substituted pyrrolidinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-10 US disclosed
EP-2061772-A2 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS Curis, Inc. (US) 2009-05-27 EP disclosed
WO-2009036051-A1 BCL-2 INHIBITORS CONTAINING A ZINC BINDING MOIETY CURIS, INC. (US) 2009-03-19 WO disclosed
WO-2009036035-A1 BCL-2 INHIBITORS CURIS, INC. (US) 2009-03-19 WO disclosed
US-20080221132-A1 Multi-Functional Small Molecules as Anti-Proliferative Agents CURIS, INC. 2008-09-11 US disclosed
WO-2008033747-A9 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS INC (MA) 2008-07-24 WO disclosed
WO-2008033747-A2 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS, INC. (US) 2008-03-20 WO disclosed
US-20070032473-A1 Substituted amides and their use as medicaments GERLACH KAI 2007-02-08 US disclosed
US-20060142263-A1 NEW SUBSTITUTED PYRROLIDINONES, THEIR MANUFACTURE AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 US 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 (7 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-20080221132-A1 Multi-Functional Small Molecules as Anti-Proliferative Agents HDAC1, HDAC6, HDAC5 HTT 2183/4885MTNR1A 3457/4885PDE5A 3629/4885
US-20230020952-A1 MACROCYCLES COMPRISING A 4-AMIDO-2,4-PENTADIENOATE MOIETY FOR THE TREATMENT OF HYPOXIC CANCERS DLD, HIF1A, DPYD HTT 3052/4885MTNR1A 1900/4885PDE5A 3467/4885
US-20060142263-A1 NEW SUBSTITUTED PYRROLIDINONES, THEIR MANUFACTURE AND THEIR USE AS MEDICAMENTS PYCR1, OAT, UROD HTT 2738/4885MTNR1A 470/4885PDE5A 1171/4885
US-20070032473-A1 Substituted amides and their use as medicaments OAT, HLA-B, BCAT2 HTT 3414/4885MTNR1A 310/4885PDE5A 3429/4885
US-20150328239-A1 Chemical Compounds BCL2, BCL2L1, BAX HTT 3192/4885MTNR1A 2899/4885PDE5A 1627/4885
US-20160176906-A1 Chemical Compounds BCL2, BCL2L1, BAX HTT 3192/4885MTNR1A 2899/4885PDE5A 1627/4885
US-20130310344-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BCL2, BAX, BCLAF1 HTT 3761/4885MTNR1A 3368/4885PDE5A 3063/4885

“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.