SCHEMBL692423

SCHEMBL692423

N=C1c2ccccc2NC1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.35
NOS2 P35228 4/20 0.34
TNKS2 Q9H2K2 3/20 0.34
KMT2A Q03164 4/20 0.34
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
GFER P55789 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
PDGFRA P16234 1/20 0.31
FER P16591 1/20 0.31
LTK P29376 1/20 0.31
CDK8 P49336 1/20 0.31
ACVR1 Q04771 1/20 0.31

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
SCHEMBL19492450 0.73 TSHR (0.47) IDO1TNKS2KMT2ATSHRLMNA
SCHEMBL31739367 0.73 TSHR (0.47) IDO1TNKS2KMT2ATSHRLMNA
SCHEMBL22268104 0.67 HTR2A (0.35) IDO1TNKS2KMT2ATSHRMEN1
SCHEMBL22130542 0.65 IDO1 (0.36) IDO1NOS2TNKS2KMT2ALMNA
SCHEMBL13949315 0.64 MAPT (0.43) IDO1NOS2TNKS2KMT2ATSHR
SCHEMBL11100808 0.63 HRH1 (0.39) IDO1KMT2ALMNAGAAKDM4E
SCHEMBL22478921 0.62 BRD3 (0.40) KMT2ATSHRLMNAMEN1GAA
SCHEMBL23615537 0.62 CREBBP (0.59) IDO1KMT2ATSHRMEN1GAA
SCHEMBL22522329 0.62 IDO1 (0.38) IDO1NOS2TNKS2KMT2ATSHR
SCHEMBL19465426 0.62 TNKS2 (0.55) TNKS2KMT2ATSHRMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403789-B2 Benzofuran-containing amino acid inhibitors of cytochrome P450 SEQUOIA PHARMACEUTICALS, INC. (US) 2016-08-02 US disclosed
US-20150284352-A1 METHODS FOR INHIBITING DRUG DEGRADATION SEQUOIA PHARMACEUTICALS INC (US) 2015-10-08 US disclosed
US-8952056-B2 Methods for inhibiting drug degradation SEQUOIA PHARMACEUTICALS, INC. (US) 2015-02-10 US disclosed
US-8703700-B2 Bimacrocylic HCV NS3 protease inhibitors SEQUOIA PHARMACEUTICALS, INC. (US) 2014-04-22 US disclosed
US-8673970-B2 HIV protease inhibitor and cytochrome p450 inhibitor combinations SEQUOIA PHARMACEUTICALS, INC. (US) 2014-03-18 US disclosed
US-20120141414-A1 Bimacrocylic HCV NS3 Protease Inhibitors SEQUOIA PHARMACEUTICALS, INC. (US) 2012-06-07 US disclosed
EP-2432318-A1 BIMACROCYCLIC HCV NS3 PROTEASE INHIBITORS Sequoia Pharmaceuticals, Inc. (US) 2012-03-28 EP disclosed
EP-2422780-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
EP-2422781-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
US-20110124578-A1 AMINO ACID INHIBITORS OF CYTOCHROME P450 SEQUOIA PHARMACEUTICALS INC. (US) 2011-05-26 US disclosed
US-7507763-B2 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2009-03-24 US disclosed
US-7378441-B2 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS, INC. (US) 2008-05-27 US disclosed
WO-2005087728-A9 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS INC (US) 2007-04-26 WO disclosed
EP-1750696-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2007-02-14 EP disclosed
EP-1732891-A1 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2006-12-20 EP disclosed
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2006-11-16 US disclosed
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2005-12-01 US disclosed
WO-2005110428-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-11-24 WO disclosed
US-20050209301-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2005-09-22 US disclosed
WO-2005087728-A1 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-09-22 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 (6 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-20110124578-A1 AMINO ACID INHIBITORS OF CYTOCHROME P450 CYP3A43, CYP7A1, CYP3A5 IDO1 275/4885NOS2 394/4885TNKS2 3678/4885
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME IDO1 1811/4885NOS2 4298/4885TNKS2 3985/4885
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME IDO1 1811/4885NOS2 4298/4885TNKS2 3985/4885
US-20120141414-A1 Bimacrocylic HCV NS3 Protease Inhibitors HAVCR2, CTRC, CTSC IDO1 1960/4885NOS2 3719/4885TNKS2 2335/4885
US-20150284352-A1 METHODS FOR INHIBITING DRUG DEGRADATION CYP2E1, CYP3A43, CYP3A5 IDO1 767/4885NOS2 448/4885TNKS2 1252/4885
US-20050209301-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME IDO1 1811/4885NOS2 4298/4885TNKS2 3985/4885

“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.