SCHEMBL3972954

SCHEMBL3972954

COC(=O)C1(N)CCC(=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
KCNA3 P22001 2/20 0.32
LMNA P02545 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30

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
Hydrochloric Acid SCHEMBL29619439 0.98 NPSR1 (0.34) NPSR1SMN1; SMN2KCNA3LMNAPDE4A
SCHEMBL231396 0.82
Hydrochloric Acid SCHEMBL27585730 0.80 NPSR1 (0.41) NPSR1LMNAMEN1KMT2ACYP4F2
Bromide SCHEMBL21798034 0.80
Hydrochloric Acid SCHEMBL233616 0.80
SCHEMBL21469230 0.79 POLB (0.41) SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL5663490 0.79 MAPK1 (0.36)
SCHEMBL12462742 0.78 NPSR1 (0.38) NPSR1SMN1; SMN2KCNA3LMNAPDE4A
SCHEMBL1433032 0.78
SCHEMBL331908 0.78 NPSR1 (0.50) NPSR1SMN1; SMN2LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260092069-A1 SUBSTITUTED INDAZOLES AS IRAK4 INHIBITORS ASTRAZENECA AB (SE) 2026-04-02 US disclosed
US-12448385-B2 Substituted indazoles as IRAK4 inhibitors ASTRAZENECA AB (SE) 2025-10-21 US disclosed
EP-3774761-B1 METHOD FOR THE PREPARATION OF CYCLOHEXANAMINO ACID ESTERS AND SPIROKETAL SUBSTITUTED CYCLIC KETOENOLS BAYER AG (DE) 2024-09-11 EP disclosed
US-20240294539-A1 PROCESS FOR PREPARING SUBSTITUTED CYCLOHEXANE AMINO ACID ESTERS AND SPIROKETAL-SUBSTITUTED CYCLIC KETO-ENOLS BAYER AKTIENGESELLSCHAFT (DE) 2024-09-05 US disclosed
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
US-12006327-B2 Process for preparing substituted cyclohexane amino acid esters and spiroketal-substituted cyclic keto-enols BAYER AKTIENGESELLSCHAFT (DE) 2024-06-11 US disclosed
US-20240182479-A1 SUBSTITUTED INDAZOLES AS IRAK4 INHIBITORS ASTRAZENECA AB (SE) 2024-06-06 US disclosed
EP-3478672-B1 BIARYLMETHYL HETEROCYCLES UNIV MONTREAL (CA) 2024-04-10 EP disclosed
US-20240024488-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2024-01-25 US disclosed
US-20240024488-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2024-01-25 US disclosed
WO-2014160649-A1 HYDROXAMIC ACID DERIVATIVES AS LPXC INHIBITORS FOR THE TREATMENT OF BACTERIAL INFECTIONS NOVARTIS AG (CH) 2014-10-02 WO disclosed
EP-1893246-A4 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING UNIV EMORY (US) 2009-05-06 EP disclosed
EP-1893246-A2 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING Emory University (US) 2008-03-05 EP disclosed
CN-101098852-A Glycogen phosphorylase inhibitor compounds and pharmaceutical compositions thereof SMITHKLINE BEECHAM CORP (US) 2008-01-02 CN disclosed
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof SMITHKLINE BEECHAM CORPORATION (US) 2007-10-25 US disclosed
EP-1812383-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF Smithkline Beecham Corporation (US) 2007-08-01 EP disclosed
WO-2007001958-A2 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 2007-01-04 WO disclosed
WO-2007001958-A2 STEREOSELECTIVE SYNTHESIS OF AMINO ACID ANALOGS FOR TUMOR IMAGING EMORY UNIVERSITY (US) 2007-01-04 WO disclosed
US-20060292073-A1 Stereoselective Synthesis of Amino Acid Analogs for Tumor Imaging EMORY UNIVERSITY (US) 2006-12-28 US disclosed
WO-2006052722-A1 GLYCOGEN PHOSPHORYLASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF SMITHKLINE BEECHAM CORPORATION (US) 2006-05-18 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 (9 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-20060292073-A1 Stereoselective Synthesis of Amino Acid Analogs for Tumor Imaging PAICS, BCAT1, SLC1A5 NPSR1 1313/4885SMN1; SMN2 1824/4885KCNA3 3555/4885
US-20070249670-A1 Glycogen Phosphorylase Inhibitor Compounds and Pharmaceutical Compositions Thereof PYGM, PYGL, GYS1 NPSR1 4240/4885SMN1; SMN2 2240/4885KCNA3 3997/4885
US-20260092069-A1 SUBSTITUTED INDAZOLES AS IRAK4 INHIBITORS IRAK3, IRAK4, IRAK2 NPSR1 3295/4885SMN1; SMN2 1935/4885KCNA3 1905/4885
US-20240294539-A1 PROCESS FOR PREPARING SUBSTITUTED CYCLOHEXANE AMINO ACID ESTERS AND SPIROKETAL-SUBSTITUTED CYCLIC KETO-ENOLS BCAT1, BCAT2, BCKDK NPSR1 1012/4885SMN1; SMN2 4273/4885KCNA3 767/4885
US-12448385-B2 Substituted indazoles as IRAK4 inhibitors IRAK4, IRAK1, IRAK2 NPSR1 4370/4885SMN1; SMN2 3732/4885KCNA3 1462/4885
US-12006327-B2 Process for preparing substituted cyclohexane amino acid esters and spiroketal-substituted cyclic keto-enols BCAT1, BCAT2, BCKDK NPSR1 1012/4885SMN1; SMN2 4273/4885KCNA3 767/4885
US-20240182479-A1 SUBSTITUTED INDAZOLES AS IRAK4 INHIBITORS IRAK4, IRAK3, IRAK2 NPSR1 4282/4885SMN1; SMN2 2315/4885KCNA3 2731/4885
US-20240024488-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB NPSR1 4599/4885SMN1; SMN2 40/4885KCNA3 3643/4885
US-12037324-B2 Biarylmethyl heterocycles ARRB1, ADRB2, ADRB1 NPSR1 98/4885SMN1; SMN2 4686/4885KCNA3 1084/4885

“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.