SCHEMBL4176542

SCHEMBL4176542

CC(C)(N)C(=O)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
MEN1 O00255 1/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
MMP1 P03956 1/20 0.42
MMP3 P08254 1/20 0.42
MMP8 P22894 1/20 0.42
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL2746392 0.85 RECQL (0.62) SMN1; SMN2ALDH1A1MEN1KMT2AHTT
SCHEMBL800634 0.82 SMN1; SMN2 (0.55) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749086 0.82 SMN1; SMN2 (0.55) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749185 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749056 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749144 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749221 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749227 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8392706 0.80 SMN1; SMN2 (0.53) SMN1; SMN2USP2ALDH1A1CA12CA1
SCHEMBL8749184 0.80 SMN1; SMN2 (0.58) SMN1; SMN2USP2ALDH1A1CA12CA1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12116343-B2 Inhibitors of APOL1 and methods of using same VERTEX PHARMACEUTICALS INCORPORATED (US) 2024-10-15 US disclosed
WO-2023154344-A1 2-METHYL-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO[2,3-C]PYRAN] DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 WO disclosed
US-20220340523-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMACEUTICALS INCORPORATED 2022-10-27 US disclosed
US-8324176-B2 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-12-04 US disclosed
EP-1548024-B1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL (JP) 2012-06-06 EP disclosed
US-7635684-B2 treatment of disease associated with hyperglycemia: diabetes, impaired glucose tolerance, impaired fasting glycemia, diabetic complications or obesity; e.g. -[(4-{3-[N-(Carbamoylmethyl)-N-(methanesulfonyl)amino]-propoxy}-2-methylphenyl)methyl]-3-( beta -D-glucopyranosyloxy)-5-isopropyl-1H-pyrazole KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-12-22 US disclosed
US-20090203633-A1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL CO., LTD (JP) 2009-08-13 US disclosed
CN-100413878-C Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL COMPANY (JP) 2008-08-27 CN disclosed
EP-1297022-B1 NOVEL PHOTOINITIATORS KIMBERLY CLARK CO (US) 2006-07-19 EP disclosed
US-20050272669-A1 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-12-08 US disclosed
CN-1688597-A Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL COMPANY (JP) 2005-10-26 CN disclosed
EP-1548024-A1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2005-06-29 EP disclosed
EP-1297022-A1 NOVEL PHOTOINITIATORS AND APPLICATIONS THEREFOR Kimberly-Clark Worldwide, Inc. (US) 2003-04-02 EP disclosed
US-6486227-B2 FOR USE IN GENERATING A REACTIVE SPECIES POLYMERIZING POLYMERIZABLE MATERIALS, FOR CURING UNSATURATED OLIGOMER/MONOMER MIXTURE, AND LAMINATING USING PHOTOINITIATORS, FOR INKS, ADHESIVES KIMBERLY-CLARK WORLDWIDE, INC. 2002-11-26 US disclosed
US-20020099111-A1 Novel photoinitiators and applications therefor MIND FUSION, LLC 2002-07-25 US disclosed
WO-2002000735-A1 NOVEL PHOTOINITIATORS AND APPLICATIONS THEREFOR KIMBERLY-CLARK WORLDWIDE, INC. (US) 2002-01-03 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-20220340523-A1 INHIBITORS OF APOL1 AND METHODS OF USING SAME APOL1, APOB, NPC1L1 SMN1; SMN2 3088/4885USP2 2296/4885ALDH1A1 1585/4885
US-12116343-B2 Inhibitors of APOL1 and methods of using same APOL1, APOB, NPC1L1 SMN1; SMN2 3088/4885USP2 2296/4885ALDH1A1 1585/4885
US-20090203633-A1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF UGGT1, GCKR, SLC5A1 SMN1; SMN2 4382/4885USP2 4450/4885ALDH1A1 335/4885
US-20020099111-A1 Novel photoinitiators and applications therefor ARL1, VCL, RAD54L SMN1; SMN2 4781/4885USP2 3530/4885ALDH1A1 137/4885
US-20050272669-A1 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof UGGT1, GCKR, SLC5A1 SMN1; SMN2 4382/4885USP2 4450/4885ALDH1A1 335/4885

“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.