SCHEMBL23347477

SCHEMBL23347477

CC(C)(C)c1ccc(CC(C)(CCC(C)(C)c2ccccn2)c2c[nH]cn2)[nH]1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL19085497 0.77
SCHEMBL21413937 0.62 CHRM2 (0.49)
SCHEMBL18427298 0.62 SMN1; SMN2 (0.47)
SCHEMBL12803075 0.61 SMN1; SMN2 (0.45)
SCHEMBL27800482 0.61 SMN1; SMN2 (0.45)
SCHEMBL25054047 0.61 SMN1; SMN2 (0.45)
SCHEMBL13077728 0.61 SMN1; SMN2 (0.50)
SCHEMBL24065677 0.60 SMN1; SMN2 (0.41)
SCHEMBL21677362 0.60 SMN1; SMN2 (0.35)
SCHEMBL20468593 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11426393-B2 Prolyl hydroxylase inhibitors and methods of use AKEBIA THERAPEUTICS, INC. (US) 2022-08-30 US disclosed
US-20220117946-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2022-04-21 US disclosed
US-20210137901-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2021-05-13 US disclosed