SCHEMBL355693

SCHEMBL355693

CCCCOC(=O)N1CCC(C(=O)O)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.58
LMNA P02545 3/20 0.58
POLB P06746 1/20 0.58
GAA P10253 2/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
S1PR5 Q9H228 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CHRM1 P11229 2/20 0.46
CHRM2 P08172 1/20 0.45
PKM P14618 1/20 0.43
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
THRB P10828 1/20 0.42
ATM Q13315 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42

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
Isonipecotic Acid SCHEMBL7473381 0.92 SMN1; SMN2 (0.50) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL7018944 0.92 CHRM1 (0.59) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL14159621 0.91 SMN1; SMN2 (0.51) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL28253726 0.91 SMN1; SMN2 (0.51) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL2345851 0.91 SMN1; SMN2 (0.51) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL11578382 0.90 GAA (0.56) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL7096747 0.87 SMN1; SMN2 (0.58) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL3664936 0.87 LMNA (0.58) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL5823241 0.86 GAA (0.73) SMN1; SMN2LMNAPOLBGAANPC1
SCHEMBL7449135 0.85 POLB (0.63) SMN1; SMN2LMNAPOLBGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384512-A1 PROTEIN TYROSINE PHOSPHATASE TARGETING LIGANDS Calico Life Sciences LLC (US) 2024-06-19 EP disclosed
WO-2023102140-A1 TMPRSS2 INHIBITORS AND METHODS OF USE TOPSPIN THERAPEUTICS, INC. (US) 2023-06-08 WO disclosed
WO-2023019166-A1 PROTEIN TYROSINE PHOSPHATASE TARGETING LIGANDS CALICO LIFE SCIENCES LLC (US) 2023-02-16 WO disclosed
WO-2016040078-A1 SUBSTITUTED PHENYL IMIDAZOLYL PIPERIDYL COMPOUNDS AS P70S6K1 INHIBITORS ELI LILLY AND COMPANY (US) 2016-03-17 WO disclosed
EP-2968593-A1 BIOLOGICALLY ACTIVE MOLECULES, CONJUGATES THEREOF, AND THERAPEUTIC USES Regeneron Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
EP-2414327-B1 HETEROCYCLIC COMPOUNDS AS AUTOTAXIN INHIBITORS MERCK PATENT GMBH (DE) 2014-11-19 EP disclosed
US-8841324-B2 Heterocyclic compounds as autotaxin inhibitors MERCK PATENT GMBH (DE) 2014-09-23 US disclosed
WO-2014145090-A1 BIOLOGICALLY ACTIVE MOLECULES, CONJUGATES THEREOF, AND THERAPEUTIC USES REGENERON PHARMACEUTICALS, INC. (US) 2014-09-18 WO disclosed
CN-102365271-B Heterocyclic compounds as autotaxin inhibitors MERCK PATENT GMBH 2014-05-14 CN disclosed
US-8569299-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP (US) 2013-10-29 US disclosed
EP-0883405-A4 AMIDINO PROTEASE INHIBITORS DIMENSIONAL PHARM INC (US) 1999-04-28 EP disclosed
WO-1999006390-A1 CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 ELAN PHARMACEUTICALS, INC. (US) 1999-02-11 WO disclosed
EP-0891362-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1999-01-20 EP disclosed
EP-0883405-A1 AMIDINO PROTEASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1998-12-16 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed
WO-1997036903-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1997-10-09 WO disclosed
WO-1997024135-A1 AMIDINO PROTEASE INHIBITORS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1997-07-10 WO disclosed
US-5612362-A FOR TREATING PAIN, INFLAMMATION, MIGRAINE OR ARTHRITIS MERCK SHARP & DOHME LTD. (GB) 1997-03-18 US disclosed
WO-1994010168-A1 IMIDAZOLINONE AND OXAZOLINONE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1994-05-11 WO disclosed
EP-0000167-A1 1,2,3,6-Tetrahydroisonicotinic acid and derivatives thereof, methods and starting products for their preparation, and pharmaceutical compositions containing them. Krogsgaard-Larsen, Povl (DK) 1979-01-10 EP disclosed