SCHEMBL3666785

SCHEMBL3666785

CC(C)(C)OC(=O)Nc1ccncc1O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.48
▸ CYP17A1 P05093 4/20 0.47
▸ RAB9A P51151 1/20 0.44
▸ METAP1 P53582 1/20 0.41
▸ BRS3 P32247 1/20 0.41
▸ ATR Q13535 1/20 0.41
▸ PSMB8 P28062 1/20 0.39
▸ LATS1 O95835 2/20 0.38

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
SCHEMBL8375133 0.87 CYP17A1 (0.41) NAMPTCYP17A1RAB9ABRS3ATR
SCHEMBL18522430 0.87 NAMPT (0.50) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL2107971 0.84 NAMPT (0.48) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL4827917 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL16307603 0.83 CYP17A1 (0.55) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL536056 0.83 NOD2 (0.50) NAMPTCYP17A1RAB9AMETAP1ATR
SCHEMBL15039524 0.83 CYP17A1 (0.55) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL5746021 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9A
SCHEMBL4037373 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL31707397 0.83 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951075-B2 Pteridines useful as HCV inhibitors and methods for the preparation thereof JANSSEN SCIENCES IRELAND UC (IE) 2018-04-24 — — US disclosed
US-9951075-B2 Pteridines useful as HCV inhibitors and methods for the preparation thereof JANSSEN SCIENCES IRELAND UC (IE) 2018-04-24 — — US disclosed
US-20170275288-A1 PTERIDINES USEFUL AS HCV INHIBITORS AND METHODS FOR THE PREPARATION THEREOF JANSSEN SCIENCES IRELAND UC (IE) 2017-09-28 — — US disclosed
US-20170275288-A1 PTERIDINES USEFUL AS HCV INHIBITORS AND METHODS FOR THE PREPARATION THEREOF JANSSEN SCIENCES IRELAND UC (IE) 2017-09-28 — — US disclosed
US-9708328-B2 Pteridines useful as HCV inhibitors and methods for the preparation thereof JANSSEN SCIENCES IRELAND UC (IE) 2017-07-18 — — US disclosed
US-9708328-B2 Pteridines useful as HCV inhibitors and methods for the preparation thereof JANSSEN SCIENCES IRELAND UC (IE) 2017-07-18 — — US disclosed
US-20160158238-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof Janssen Sciencies Ireland UC (IE) 2016-06-09 — — US disclosed
US-20160158238-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof Janssen Sciencies Ireland UC (IE) 2016-06-09 — — US disclosed
US-20160159803-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof Janssen Sciences Ireland Unlimited Company (IE) 2016-06-09 — — US disclosed
US-20160159803-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof Janssen Sciences Ireland Unlimited Company (IE) 2016-06-09 — — US disclosed
EP-1881834-B1 PTERIDINES USEFUL AS HCV INHIBITORS AND METHODS FOR THE PREPARATION THEREOF JANSSEN R & D IRELAND (IE) 2012-04-25 — — EP disclosed
US-8022077-B2 Pyrido[2,3-d]pyrimidines useful as HCV inhibitors, and methods for the preparation thereof TIBOTEC PHARMACEUTICALS LTD. (IE) 2011-09-20 — — US disclosed
US-8022077-B2 Pyrido[2,3-d]pyrimidines useful as HCV inhibitors, and methods for the preparation thereof TIBOTEC PHARMACEUTICALS LTD. (IE) 2011-09-20 — — US disclosed
EP-1888580-B1 PYRIDO[2,3-D]PYRIMIDINES USEFUL AS HCV INHIBITORS, AND METHODS FOR THE PREPARATION THEREOF TIBOTEC PHARM LTD (IE) 2010-03-03 — — EP disclosed
US-20090156595-A1 Pteridines useful as HCV inhibitors and methods for the preparation thereof TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-06-18 — — US disclosed
US-20090156595-A1 Pteridines useful as HCV inhibitors and methods for the preparation thereof TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-06-18 — — US disclosed
US-20090131460-A1 PYRIDO[2,3-D]PYRIMIDINES USEFUL AS HCV INHIBITORS, AND METHODS FOR THE PREPARATION THEREOF TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-05-21 — — US disclosed
US-20090131460-A1 PYRIDO[2,3-D]PYRIMIDINES USEFUL AS HCV INHIBITORS, AND METHODS FOR THE PREPARATION THEREOF TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-05-21 — — US disclosed
WO-2006120251-A1 PTERIDINES USEFUL AS HCV INHIBITORS AND METHODS FOR THE PREPARATION THEREOF TIBOTEC PHARMACEUTICALS LTD. (IE) 2006-11-16 — — WO disclosed
WO-2004024159-A1 INHIBITORS OF TFGβ SCIOS INC. (US) 2004-03-25 — — 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 (5 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-20090131460-A1 PYRIDO[2,3-D]PYRIMIDINES USEFUL AS HCV INHIBITORS, AND METHODS FOR THE PREPARATION THEREOF DPYD, TYMP, PNP NAMPT 52/4885CYP17A1 4222/4885RAB9A 2878/4885
US-20160159803-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof HCCS, HAVCR2, MAVS NAMPT 12/4885CYP17A1 2834/4885RAB9A 1584/4885
US-20170275288-A1 PTERIDINES USEFUL AS HCV INHIBITORS AND METHODS FOR THE PREPARATION THEREOF HCCS, HAVCR2, MAVS NAMPT 12/4885CYP17A1 2834/4885RAB9A 1584/4885
US-20160158238-A1 Pteridines Useful As HCV Inhibitors And Methods For The Preparation Thereof HCCS, HAVCR2, MAVS NAMPT 12/4885CYP17A1 2834/4885RAB9A 1584/4885
US-20090156595-A1 Pteridines useful as HCV inhibitors and methods for the preparation thereof HCCS, HAVCR2, MAVS NAMPT 12/4885CYP17A1 2834/4885RAB9A 1584/4885

“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.

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