SCHEMBL948434

SCHEMBL948434

C1CCC(N2CCOCC2)[N]C1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2A13 Q16696 1/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MCOLN3 Q8TDD5 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
SCHEMBL1582708 0.98 MAPT (0.33) ALDH1A1SMN1; SMN2CYP2A13HPGDMAPT
SCHEMBL170248 0.94 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2CYP2A13HPGD
SCHEMBL1428236 0.82
SCHEMBL157427 0.82 CYP2D6 (0.33)
SCHEMBL2229452 0.80 CYP2D6 (0.32)
SCHEMBL10891279 0.80 CYP2D6 (0.32)
SCHEMBL3658217 0.80 CYP2D6 (0.32)
SCHEMBL286072 0.80 CYP2D6 (0.32)
SCHEMBL6050828 0.80 CYP2D6 (0.32)
SCHEMBL4712511 0.80 CYP2D6 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253575-A1 PYRROLIDINE AMINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE HOFFMANN-LA ROCHE INC. (US) 2021-08-19 US claimed
EP-3847165-A1 NOVEL PYRROLIDINE AMINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE F. Hoffmann-La Roche AG (CH) 2021-07-14 EP claimed
CN-112673003-A Novel pyrrolidine amine compounds for the treatment of autoimmune diseases 豪夫迈·罗氏有限公司 2021-04-16 CN claimed
US-9834513-B2 Benzylamine derivatives Kalvista Pharmceuticals Limited (GB) 2017-12-05 US claimed
US-20170253561-A1 Benzylamine Derivatives KALVISTA PHARMACEUTICALS LTD (GB) 2017-09-07 US claimed
US-9670157-B2 Benzylamine derivatives KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-06-06 US claimed
EP-2364298-B1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2016-08-03 EP claimed
US-9370519-B2 Macrocyclic FLT3 kinase inhibitors ONCODESIGN S.A. (FR) 2016-06-21 US claimed
EP-2760867-B1 MACROCYCLIC FLT3 KINASE INHIBITORS ONCODESIGN SA (FR) 2016-03-16 EP claimed
US-20160039752-A1 BENZYLAMINE DERIVATIVES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-02-11 US claimed
EP-0547168-A1 CERTAIN CYCLOALKYL IMIDAZOPYRIMIDINES, A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1993-06-23 EP claimed
EP-0538314-A1 INDANO PYRROLIDINE CARBAMATES. PFIZER (US) 1993-04-28 EP claimed
WO-1992004351-A1 CERTAIN CYCLOALKYL IMIDAZOPYRIMIDINES, A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1992-03-19 WO claimed
WO-1992000961-A1 INDANO PYRROLIDINE CARBAMATES PFIZER INC. (US) 1992-01-23 WO claimed
EP-0342682-A2 Hydroxamate derivatives of selected nonsteroidal anti-inflammatory acyl residues having cyclooxygenase and 5-lipoxygenase inhibition WARNER-LAMBERT COMPANY (US) 1989-11-23 EP claimed
US-4839358-A ANALGESICS, ANTIDEPRESSANTS, ANTIANXIETY AGENTS ROUSSEL UCLAF (FR) 1989-06-13 US claimed
US-4816571-A Chemical capping by phosphitylation during oligonucleotide synthesis APPLIED BIOSYSTEMS, INC. (US) 1989-03-28 US claimed
EP-0251937-A1 Tricyclic agonist derivatives of cholinergic receptors, and medicines containing them SANOFI (FR) 1988-01-07 EP claimed
EP-0031266-B1 1-AMINO-2-PROPANOL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTIC USE ELF SANOFI (FR) 1983-02-09 EP claimed
US-4145541-A ANTIINFLAMMATORY E. R. SQUIBB & SONS, INC. (US) 1979-03-20 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20210253575-A1 PYRROLIDINE AMINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE ARG1, PRMT1, PADI1 ALDH1A1 942/4885SMN1; SMN2 2019/4885CYP2A13 3887/4885
US-20160039752-A1 BENZYLAMINE DERIVATIVES BDKRB1, BDKRB2, KLKB1 ALDH1A1 2364/4885SMN1; SMN2 2831/4885CYP2A13 1586/4885
US-20170253561-A1 Benzylamine Derivatives BDKRB1, BDKRB2, KLKB1 ALDH1A1 2364/4885SMN1; SMN2 2831/4885CYP2A13 1586/4885

“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.