SCHEMBL2724877

SCHEMBL2724877

O=C(NCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLD2 O14939 19/20 1.00
PLD1 Q13393 16/20 1.00

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
SCHEMBL31060758 1.00 PLD2 (1.00) PLD2PLD1
SCHEMBL14845989 0.93 PLD2 (1.00) PLD2PLD1
SCHEMBL14845986 0.90 PLD2 (1.00) PLD2PLD1
SCHEMBL14845985 0.89 PLD2 (1.00) PLD2PLD1
SCHEMBL11718350 0.88 PLD2 (1.00) PLD2PLD1
SCHEMBL14846012 0.88 PLD2 (1.00) PLD2PLD1
SCHEMBL14846008 0.88 PLD2 (1.00) PLD2PLD1
SCHEMBL10311349 0.87 PLD2 (1.00) PLD2PLD1
SCHEMBL11721660 0.87 PLD2 (1.00) PLD2PLD1
SCHEMBL11768171 0.87 PLD2 (1.00) PLD2PLD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160271114-A1 Composition for preventing or treating bacterial infectious disease comprising phospholipase D2 inhibitor Research & Business Foundation Sungkyunkwan University (KR) 2016-09-22 US claimed
US-9267122-B2 Modulation of phospholipase D for the treatment of neurodegenerative disorders THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-02-23 US claimed
US-20120178719-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-07-12 US claimed
CN-102459584-A Modulation of phospholipase d for treatment of neurodegenerative disorders UNIV COLUMBIA 2012-05-16 CN claimed
EP-2435563-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS The Trustees of Columbia University in the City of New York (US) 2012-04-04 EP claimed
WO-2010138869-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-12-02 WO claimed
US-10039715-B2 Liposomal formulation of nonglycosidic ceramides and uses thereof LUDWIG INSTITUTE FOR CANCER RESEARCH LTD. (US) 2018-08-07 US disclosed
EP-2654779-B1 LIPOSOMAL FORMULATION OF NONGLYCOSIDIC CERAMIDES AND USES THEREOF LUDWIG INST FOR CANCER RES LTD (US) 2018-02-28 EP disclosed
US-20170319611-A1 METHODS AND COMPOSITIONS COMPRISING AKT INHIBITORS AND/OR PHOSPHOLIPASE D INHIBITORS UNIV VANDERBILT (US) 2017-11-09 US disclosed
US-20170105936-A1 LIPOSOMAL FORMULATION OF NONGLYCOSIDIC CERAMIDES AND USES THEREOF LUDWIG INSTITUTE FOR CANCER RESEARCH LTD. (US) 2017-04-20 US disclosed
US-20160296506-A1 Methods and Compositions for Treating HIV Infection VANDERBILT UNIVERSITY 2016-10-13 US disclosed
US-20160296506-A1 Methods and Compositions for Treating HIV Infection VANDERBILT UNIVERSITY 2016-10-13 US disclosed
US-9453017-B2 Antiviral therapies with phospholipase D inhibitors VANDERBILT UNIVERSITY (US) 2016-09-27 US disclosed
US-20120178719-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-07-12 US disclosed
US-20120178719-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-07-12 US disclosed
WO-2012088414-A1 LIPOSOMAL FORMULATION OF NONGLYCOSIDIC CERAMIDES AND USES THEREOF LUDWIG INSTITUTE FOR CANCER RESEARCH LTD. (US) 2012-06-28 WO disclosed
WO-2012064072-A2 COMPOSITION FOR PREVENTING OR TREATING RHEUMATOID ARTHRITIS COMPRISING A PHOSPHOLIPASE D1 INHIBITOR AS AN ACTIVE INGREDIENT 부산대학교 산학협력단 (KR) 2012-05-18 WO disclosed
CN-102459584-A Modulation of phospholipase d for treatment of neurodegenerative disorders UNIV COLUMBIA 2012-05-16 CN disclosed
EP-2435563-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS The Trustees of Columbia University in the City of New York (US) 2012-04-04 EP disclosed
WO-2010138869-A1 MODULATION OF PHOSPHOLIPASE D FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-12-02 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 (4 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-20170105936-A1 LIPOSOMAL FORMULATION OF NONGLYCOSIDIC CERAMIDES AND USES THEREOF CERS2, CERT1, SGMS1 PLD2 201/4885PLD1 184/4885
US-20160296506-A1 Methods and Compositions for Treating HIV Infection SMPD3, PLD3, SMPD1 PLD2 5/4885PLD1 4/4885
US-10039715-B2 Liposomal formulation of nonglycosidic ceramides and uses thereof CERS2, CERT1, SGMS1 PLD2 201/4885PLD1 184/4885
US-20170319611-A1 METHODS AND COMPOSITIONS COMPRISING AKT INHIBITORS AND/OR PHOSPHOLIPASE D INHIBITORS PLD1, PLD2, PIK3CD PLD2 2/4885PLD1 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.