SCHEMBL10049353

SCHEMBL10049353

CC(C)C1COC(=O)N1C

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.56
IL6ST P40189 5/20 0.43
AR P10275 1/20 0.37
STAT3 P40763 1/20 0.37
IDH1 O75874 13/20 0.36

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
SCHEMBL9926817 1.00 PIK3CD (0.56) PIK3CDIL6STARSTAT3IDH1
SCHEMBL9926814 1.00 PIK3CD (0.56) PIK3CDIL6STARSTAT3IDH1
SCHEMBL21657352 0.81 PIK3CD (0.42) PIK3CDIL6ST
SCHEMBL2033251 0.81 PIK3CD (0.42) PIK3CDIL6ST
SCHEMBL10308941 0.80 PIK3CD (0.42) PIK3CDIL6STIDH1
SCHEMBL1717114 0.79 PIK3CD (0.44) PIK3CDIL6STARSTAT3IDH1
SCHEMBL12706216 0.79 PIK3CD (0.41) PIK3CDIL6ST
SCHEMBL21657351 0.78 PIK3CD (0.40) PIK3CDIL6ST
SCHEMBL10308833 0.77 PIK3CD (0.55) PIK3CDIL6STSTAT3IDH1
SCHEMBL18391318 0.77 PIK3CD (0.55) PIK3CDIL6STSTAT3IDH1

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
EP-3464297-B1 PROCESS FOR PREPARATION OF ERIBULIN AND INTERMEDIATES THEREOF Dr Reddys Laboratories Ltd (IN) 2023-10-25 EP disclosed
US-20220177508-A1 C10-Cyclic Substituted 13-Membered Macrolides and Uses Thereof ZIKANI THERAPEUTICS, INC. 2022-06-09 US disclosed
US-11161846-B2 Substituted pyrazolo[4,3-b]pyridines and their use as GluN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2021-11-02 US disclosed
US-11091486-B2 Process for the preparation of pyrazolo[1,5-a]pyrimidines and salts thereof ARRAY BIOPHARMA, INC (US) 2021-08-17 US disclosed
US-11059799-B2 Process for preparation of eribulin and intermediates thereof DR. REDDY'S LABORATORIES LIMITED. (IN) 2021-07-13 US disclosed
US-10966985-B2 Macrocyclic compounds as ROS1 kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-04-06 US disclosed
US-20200392130-A1 SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 US disclosed
US-10836776-B2 Process for preparation of eribulin and intermediates thereof DR. REDDY'S LABORATORIES LIMITED (IN) 2020-11-17 US disclosed
US-20200216451-A1 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF ARRAY BIOPHARMA, INC. 2020-07-09 US disclosed
US-20190276470-A1 PROCESS FOR PREPARATION OF ERIBULIN AND INTERMEDIATES THEREOF DR. REDDY'S LABORATORIES LIMITED (IN) 2019-09-12 US disclosed
US-20190076436-A1 MACROCYCLIC COMPOUNDS AS ROS1 KINASE INHIBITORS ARRAY BIOPHARMA INC. 2019-03-14 US disclosed
US-9643927-B1 Process for the preparation of kinase inhibitors and intermediates thereof AERIE PHARMACEUTICALS, INC. (US) 2017-05-09 US disclosed
US-20170112842-A1 MACROCYCLIC COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2017-04-27 US disclosed
US-9624183-B2 Process for the preparation of a fluorolacton derivative GILEAD PHARMASSET LLC (US) 2017-04-18 US disclosed
US-20150315165-A1 PROCESS FOR THE PREPARATION OF A FLUOROLACTON DERIVATIVE HOFFMANN-LA ROCHE INC. (US) 2015-11-05 US disclosed
US-8865726-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors ARRAY BIOPHARMA INC. (US) 2014-10-21 US disclosed
US-20140309413-A1 METHODS OF STEREOSELECTIVE SYNTHESIS OF SUBSTITUTED NUCLEOSIDE ANALOGS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-16 US disclosed
WO-2014164533-A1 METHODS OF STEREOSELECTIVE SYNTHESIS OF SUBSTITUTED NUCLEOSIDE ANALOGS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-09 WO disclosed
US-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-07-12 US disclosed
US-8093386-B2 Thioaryl substituted inhibitors of zinc proteases and their use BRACCO IMAGING S.P.A (IT) 2012-01-10 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 (14 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-11059799-B2 Process for preparation of eribulin and intermediates thereof ERLIN1, ERLIN2, MAN1B1 PIK3CD 2826/4885IL6ST 2466/4885AR 2182/4885
US-10836776-B2 Process for preparation of eribulin and intermediates thereof ERLIN1, ERLIN2, DHPS PIK3CD 1977/4885IL6ST 2497/4885AR 2217/4885
US-20200392130-A1 SUBSTITUTED PYRAZOLO[4,3-b]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN3B, GRIN3A PIK3CD 2131/4885IL6ST 333/4885AR 840/4885
US-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MTOR, RICTOR, EIF4EBP1 PIK3CD 201/4885IL6ST 3179/4885AR 1859/4885
US-11091486-B2 Process for the preparation of pyrazolo[1,5-a]pyrimidines and salts thereof DPYD, TYMP, UMPS PIK3CD 2669/4885IL6ST 3225/4885AR 1810/4885
US-10966985-B2 Macrocyclic compounds as ROS1 kinase inhibitors ROS1, MAP3K1, MAP3K19 PIK3CD 368/4885IL6ST 1155/4885AR 1126/4885
US-20150315165-A1 PROCESS FOR THE PREPARATION OF A FLUOROLACTON DERIVATIVE CYP2B6, CYP2F1, CYP3A5 PIK3CD 3266/4885IL6ST 508/4885AR 2940/4885
US-20190276470-A1 PROCESS FOR PREPARATION OF ERIBULIN AND INTERMEDIATES THEREOF ERLIN1, ERLIN2, DHPS PIK3CD 1977/4885IL6ST 2497/4885AR 2217/4885
US-20140309413-A1 METHODS OF STEREOSELECTIVE SYNTHESIS OF SUBSTITUTED NUCLEOSIDE ANALOGS NUDT1, PAPSS1, NT5C3B PIK3CD 1822/4885IL6ST 3004/4885AR 3744/4885
US-11161846-B2 Substituted pyrazolo[4,3-b]pyridines and their use as GluN2B receptor modulators GRIN2B, GRIN3B, GRIN3A PIK3CD 2131/4885IL6ST 333/4885AR 840/4885
US-20220177508-A1 C10-Cyclic Substituted 13-Membered Macrolides and Uses Thereof RPS14, RPL12, RPL13A PIK3CD 1374/4885IL6ST 981/4885AR 3691/4885
US-20190076436-A1 MACROCYCLIC COMPOUNDS AS ROS1 KINASE INHIBITORS ROS1, MAP3K1, MAP3K19 PIK3CD 368/4885IL6ST 1155/4885AR 1126/4885
US-20200216451-A1 PROCESS FOR THE PREPARATION OF PYRAZOLO[1,5-a]PYRIMIDINES AND SALTS THEREOF DPYD, TYMP, UMPS PIK3CD 2669/4885IL6ST 3225/4885AR 1810/4885
US-20170112842-A1 MACROCYCLIC COMPOUNDS AS TRK KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K3 PIK3CD 624/4885IL6ST 791/4885AR 562/4885

“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.