SCHEMBL2608569

SCHEMBL2608569

CC1CCc2ccccc2NC1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
MAPK13 O15264 1/20 0.52
MAPK12 P53778 1/20 0.52
MAPK11 Q15759 1/20 0.52
MAPK14 Q16539 1/20 0.52
CREBBP Q92793 3/20 0.49
BRD4 O60885 2/20 0.49
MAPT P10636 1/20 0.49
BRPF1 P55201 1/20 0.46
AHR P35869 1/20 0.44
PDK2 Q15119 1/20 0.44
PYGL P06737 2/20 0.44
PYGM P11217 2/20 0.44
PARP1 P09874 1/20 0.42
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL859143 1.00 NPC1 (0.52) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL12598688 1.00 NPC1 (0.52) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL22048708 1.00 NPC1 (0.52) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL22482700 0.90 MAPT (0.54) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL14547899 0.88 MAPT (0.53) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL29744506 0.81 CREBBP (0.61) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL8986757 0.81 CREBBP (0.61) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL6221253 0.81 CREBBP (0.61) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL7419845 0.81 CREBBP (0.61) NPC1MAPK13MAPK12MAPK11MAPK14
SCHEMBL24933974 0.79 TSHR (0.44) NPC1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-25 US disclosed
US-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-25 US disclosed
US-20210238162-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-08-05 US disclosed
EP-3508484-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2021-04-07 EP disclosed
EP-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 EP disclosed
US-20190345190-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-11-14 US disclosed
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-10-17 US disclosed
US-20180086784-A1 Phosphonate analogs of HIV inhibitor compounds GILEAD SCIENCES, INC. 2018-03-29 US disclosed
US-20180086784-A1 Phosphonate analogs of HIV inhibitor compounds GILEAD SCIENCES, INC. 2018-03-29 US disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds GILEAD SCIENCES, INC. 2007-02-01 US disclosed
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds GILEAD SCIENCES, INC. 2007-02-01 US disclosed
US-20070027114-A1 Phosphonate analogs of antimetabolites GILEAD SCIENCES INC. 2007-02-01 US disclosed
WO-2007011658-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2007-01-25 WO disclosed
US-7166720-B2 Process for the preparation of α-aminosubstituted carboxylic acid amides MERCK PATENT GESELLSCHAFT (DE) 2007-01-23 US disclosed
WO-2007009109-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2007-01-18 WO disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed
WO-2006020276-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2006-02-23 WO disclosed
WO-1999015524-A1 THIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 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 (8 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-20230159508-A1 INHIBITORS OF RECEPTOR INTERACTING PROTEIN KINASE I FOR THE TREATMENT OF DISEASE RIPK1, RIPK2, RIPK4 NPC1 1506/4885MAPK13 501/4885MAPK12 545/4885
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS PIK3CA, TYMP, ITPA NPC1 678/4885MAPK13 2148/4885MAPK12 1800/4885
US-20070027114-A1 Phosphonate analogs of antimetabolites TYMP, PHOSPHO1, PHPT1 NPC1 2153/4885MAPK13 2744/4885MAPK12 2601/4885
US-20190345190-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS PIK3CA, TYMP, ITPA NPC1 678/4885MAPK13 2148/4885MAPK12 1800/4885
US-20180086784-A1 Phosphonate analogs of HIV inhibitor compounds PIK3CA, TYMP, ITPA NPC1 678/4885MAPK13 2148/4885MAPK12 1800/4885
US-20210238162-A1 CHEMICAL COMPOUNDS HPGDS, PTGS1, PTGIS NPC1 3347/4885MAPK13 4514/4885MAPK12 3974/4885
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 NPC1 626/4885MAPK13 2967/4885MAPK12 3178/4885
US-20070027113-A1 Purine nucleoside phosphorylase inhibitory phosphonate compounds PNP, TYMP, MTAP NPC1 1132/4885MAPK13 2885/4885MAPK12 2434/4885

“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.