SCHEMBL19617872

SCHEMBL19617872

C[C@@H]1CN(C(=O)O)C[C@H]1N

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 1/20 0.32
CHRNB2 P17787 4/20 0.31
CHRNA3 P32297 4/20 0.31
CHRNA4 P43681 4/20 0.31
CHRNB3 Q05901 4/20 0.31
CHRNA6 Q15825 4/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL19617869 1.00 GABRR1 (0.32) GABRR1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL19617268 1.00 GABRR1 (0.32) GABRR1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4243520 1.00 GABRR1 (0.32) GABRR1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4243523 1.00 GABRR1 (0.32) GABRR1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4243525 1.00 GABRR1 (0.32) GABRR1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL505155 0.85 FUCA1 (0.34)
SCHEMBL19816446 0.83 GABRR1 (0.39) GABRR1
SCHEMBL3620778 0.83 GABRR1 (0.39) GABRR1
SCHEMBL3620776 0.83 GABRR1 (0.39) GABRR1
SCHEMBL4627762 0.83 GABRR1 (0.39) GABRR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024127350-A1 2,6,9-TRISUBSTITUTED PURINES ASTRAZENECA AB (SE) 2024-06-20 WO disclosed
WO-2023199091-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-19 WO disclosed
EP-3893879-A1 PYRAZOLOPYRIDINE INHIBITORS OF C-JUN-N-TERMINAL KINASES AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2021-10-20 EP disclosed
EP-3508482-B1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR AND USE THEREOF NANJING TRANSTHERA BIOSCIENCES CO LTD (CN) 2020-12-16 EP disclosed
US-10744139-B2 Inhibitors of fibroblast growth factor receptor and use thereof NANJING TRANSTHERA BIOSCIENCES CO. LTD. (CN) 2020-08-18 US disclosed
WO-2020123925-A1 PYRAZOLOPYRIDINE INHIBITORS OF C-JUN-N-TERMINAL KINASES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-06-18 WO disclosed
US-20190209564-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR AND USE THEREOF NANJING TRANSTHERA BIOSCIENCES CO LTD (CN) 2019-07-11 US disclosed
EP-3508482-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR AND USE THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2019-07-10 EP disclosed
EP-3458449-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2019-03-27 EP disclosed
WO-2017201468-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-11-23 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 (2 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-10744139-B2 Inhibitors of fibroblast growth factor receptor and use thereof FGFR1, FGFR2, FGFR3 GABRR1 1584/4885CHRNB2 4703/4885CHRNA3 4737/4885
US-20190209564-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR AND USE THEREOF FGFR1, FGFR2, FGFR3 GABRR1 1584/4885CHRNB2 4703/4885CHRNA3 4737/4885

“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.