SCHEMBL29067495

SCHEMBL29067495

CCCCC(CCC)(C(=O)OC)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
AR P10275 1/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
FDPS P14324 1/20 0.33
PTPRB P23467 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
THRB P10828 1/20 0.32
PKM P14618 1/20 0.32
ACHE P22303 1/20 0.32
CES2 O00748 2/20 0.32

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
SCHEMBL15233853 0.96 EPHX1 (0.39) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL808737 0.91 MEN1 (0.38) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL31746163 0.90 KMT2A (0.36) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL25200704 0.89 MEN1 (0.44) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL7106303 0.87 MEN1 (0.47) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL7543083 0.87 MEN1 (0.47) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL23859895 0.87 MEN1 (0.47) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL25173893 0.87 MEN1 (0.47) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL486917 0.87 MEN1 (0.47) EPHX1KMT2AMEN1L3MBTL1MAPT
SCHEMBL21679729 0.85 MEN1 (0.46) EPHX1KMT2AMEN1L3MBTL1MAPT

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
CN-121186232-A Dipropylmalonic acid and detection method of impurities thereof 湖南省湘中制药有限公司 2025-12-23 CN disclosed
CN-116730832-B Preparation method of 2-propyl caproic acid 湖南大学 2024-05-07 CN disclosed
CN-116730832-A Preparation method of 2-propyl caproic acid 湖南大学 2023-09-12 CN disclosed