SCHEMBL14639360

SCHEMBL14639360

CCC(=O)C(C)CC=O

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
SCHEMBL12857912 0.80
SCHEMBL5088544 0.80
SCHEMBL12857629 0.80
SCHEMBL9171765 0.79 TDP1 (0.33)
SCHEMBL445648 0.78 GRIK1 (0.37)
SCHEMBL27962528 0.78 CA1 (0.31)
SCHEMBL9618592 0.77 CA1 (0.43)
SCHEMBL10883472 0.77 FNTA (0.32)
SCHEMBL10883476 0.77 FNTA (0.32)
SCHEMBL29263426 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230340012-A1 NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2023-10-26 US disclosed
US-20230159436-A1 APPLICATIONS OF AMIDE ANALOGS OF TRITERPENES IN CURES OF CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2023-05-25 US disclosed
US-20200199172-A1 NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2020-06-25 US disclosed
US-10590163-B2 Natural and synthetic compounds for treating cancer and other diseases PACIFIC ARROW LIMITED (CN) 2020-03-17 US disclosed
US-20170267714-A1 NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2017-09-21 US disclosed
US-20170022246-A1 NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2017-01-26 US disclosed
US-9499577-B2 Natural and synthetic compounds for treating cancer and other diseases PACIFIC ARROW LTD (CN) 2016-11-22 US disclosed
US-9434677-B2 Natural and synthetic compounds for treating cancer and other diseases PACIFIC ARROW LIMITED (HK) 2016-09-06 US disclosed
US-20140322810-A1 NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LTD (CN) 2014-10-30 US disclosed
US-8815539-B1 Methods for producing melanin and inorganic fertilizer from fermentation leachates River Road Research, Inc. (US) 2014-08-26 US disclosed
US-20140199378-A1 NEW NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LIMITED (CN) 2014-07-17 US disclosed
WO-2013012737-A1 NEW NATURAL AND SYNTHETIC COMPOUNDS FOR TREATING CANCER AND OTHER DISEASES PACIFIC ARROW LIMITED (VG) 2013-01-24 WO disclosed