SCHEMBL403305

SCHEMBL403305

[NH]C(=O)CC(O)CN1CCOCC1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ ANPEP P15144 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HSD17B10 Q99714 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ABCB1 P08183 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPK1 P28482 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
SCHEMBL402459 0.82 MEN1 (0.58) USP2TSHRATMHSD17B10SMN1; SMN2
SCHEMBL4509344 0.81 USP2 (0.64) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL4493204 0.81 USP2 (0.64) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL4495691 0.81 USP2 (0.64) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL709506 0.80 USP2 (1.00) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL14168302 0.77 USP2 (0.58) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL11185 0.76 USP2 (0.75) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL4388830 0.76 USP2 (0.75) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL2978112 0.76 USP2 (0.75) USP2ALDH1A1TSHRL3MBTL1ANPEP
SCHEMBL4384132 0.76 USP2 (0.75) USP2ALDH1A1TSHRL3MBTL1ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060166982-A1 Isotopically labelly indlinone derivatives and process for their preparation PFIZER ITALIA S.R.L. (IT) 2006-07-27 — — US claimed
EP-1542734-A1 ISOTOPICALLY LABELLED INDOLINONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION Pharmacia Italia S.p.A. (IT) 2005-06-22 — — EP claimed
WO-2004012776-A1 ISOTOPICALLY LABELLED INDOLINONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA ITALIA S.P.A. (IT) 2004-02-12 — — WO claimed
US-20190134052-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR NOVARTIS AG (CH) 2019-05-09 — — US disclosed
EP-2295402-B1 Antibacterial agents UNIV WASHINGTON (US) 2015-08-12 — — EP disclosed
US-20150141426-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR NOVARTIS PHARMACEUTICALS CORPORATION 2015-05-21 — — US disclosed
EP-2637665-B1 DEXAMETHASONE COMBINATION THERAPY UNIV TEXAS (US) 2015-04-08 — — EP disclosed
EP-2849756-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR Novartis AG (CH) 2015-03-25 — — EP disclosed
US-20140213583-A1 PI3K Inhibitor for Use in the Treatment of Bone Cancer or for Preventing Metastatic Dissemination Primary Cancer Cells into the Bone NOVARTIS AG (CH) 2014-07-31 — — US disclosed
EP-2750670-A1 PI3K INHIBITOR FOR USE IN THE TREATMENT OF BONE CANCER OR FOR PREVENTING METASTATIC DISSEMINATION PRIMARY CANCER CELLS INTO THE BONE Novartis AG (CH) 2014-07-09 — — EP disclosed
WO-2013173283-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR NOVARTIS AG (CH) 2013-11-21 — — WO disclosed
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2005-03-31 — — US disclosed
US-20040229955-A1 intracellular inhibition of bacterial polypeptide deformylase in gramnegative bacteria, UNIVERSITY OF WASHINGTON 2004-11-18 — — US disclosed
US-20040176385-A1 Small molecule PI 3-kinase inhibitors and methods of their use NOVARTIS AG (CH) 2004-09-09 — — US disclosed
WO-2004062601-A2 ANTIBACTERIAL AGENTS CHIRON CORPORATION (US) 2004-07-29 — — WO disclosed
WO-2004060308-A2 THIOSEMICARBAZONES AS ANTI-VIRALS AND IMMUNOPOTENTIATORS CHIRON CORPORATION (US) 2004-07-22 — — WO disclosed
WO-2004048365-A1 2,4,6-TRISUBSTITUTED PYRIMIDINES AS PHOSPHOTIDYLINOSITOL (PI) 3-KINASE INHIBITORS AND THEIR USE IN THE TREATMENT OF CANCER CHIRON CORPORATION (US) 2004-06-10 — — WO disclosed
US-20040077707-A1 Pyrrole based inhibitors of glycogen synthase kinase 3 NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2004-04-22 — — US disclosed
WO-2004018455-A1 PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 CHIRON CORPORATION (US) 2004-03-04 — — WO disclosed
WO-2004012776-A1 ISOTOPICALLY LABELLED INDOLINONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA ITALIA S.P.A. (IT) 2004-02-12 — — 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-20040229955-A1 intracellular inhibition of bacterial polypeptide deformylase in gramnegative bacteria, PDF, DDOST, MRPL21 USP2 3305/4885ALDH1A1 3069/4885TSHR 3937/4885
US-20150141426-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR PIK3CA, PIK3CD, PIK3R5 USP2 4546/4885ALDH1A1 3308/4885TSHR 4015/4885
US-20140213583-A1 PI3K Inhibitor for Use in the Treatment of Bone Cancer or for Preventing Metastatic Dissemination Primary Cancer Cells into the Bone PIK3CA, AKT3, AKT2 USP2 1722/4885ALDH1A1 3526/4885TSHR 3631/4885
US-20040176385-A1 Small molecule PI 3-kinase inhibitors and methods of their use PI4KB, PI4KA, PDPK1 USP2 2247/4885ALDH1A1 4016/4885TSHR 3873/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 USP2 1153/4885ALDH1A1 1173/4885TSHR 2747/4885
US-20060166982-A1 Isotopically labelly indlinone derivatives and process for their preparation CYP3A5, SLC10A2, TMEM14C USP2 4195/4885ALDH1A1 440/4885TSHR 2996/4885
US-20040077707-A1 Pyrrole based inhibitors of glycogen synthase kinase 3 GSK3B, GSK3A, PYGB USP2 4385/4885ALDH1A1 3907/4885TSHR 4317/4885
US-20190134052-A1 DOSAGE REGIMEN FOR A PI-3 KINASE INHIBITOR PIK3CA, PIK3CD, PIK3R5 USP2 4546/4885ALDH1A1 3308/4885TSHR 4015/4885

“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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