SCHEMBL19085497

SCHEMBL19085497

CC(C)(C)c1ccc(CC(C)(C)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
SCHEMBL20468593 0.79
SCHEMBL23347477 0.77
SCHEMBL23110249 0.76 BRS3 (0.31)
SCHEMBL19101474 0.74 HPGD (0.43)
SCHEMBL20021615 0.72
SCHEMBL21727183 0.70 CYP19A1 (0.33)
SCHEMBL12012896 0.69
SCHEMBL680605 0.68
SCHEMBL7179426 0.68 TAAR1 (0.34)
SCHEMBL12993678 0.68 SHBG (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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230201178-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2023-06-29 US disclosed
US-10729681-B2 Prolyl hydroxylase inhibitors and methods of use AKEBIA THERAPEUTICS, INC. (US) 2020-08-04 US disclosed
US-20190192494-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2019-06-27 US disclosed
US-9795594-B2 Human protein tyrosine phosphatase inhibitors and methods of use AERPIO THERAPEUTICS, INC. (US) 2017-10-24 US disclosed
US-20170189387-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE WARNER CHILCOTT COMPANY, LLC (PR) 2017-07-06 US disclosed