SCHEMBL24625629

SCHEMBL24625629

CC(NC(C)C1CCCCC1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
EPHX1 P07099 2/20 0.53
LMNA P02545 1/20 0.53
IDO1 P14902 2/20 0.46
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
RAB9A P51151 1/20 0.45
RECQL P46063 1/20 0.45
SIGMAR1 Q99720 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KCNQ3 O43525 1/20 0.42
KCNQ2 O43526 1/20 0.42
EPHX2 P34913 2/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41

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
SCHEMBL28546994 1.00 GAA (0.61) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL1915296 0.98 GAA (0.62) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL27877893 0.98 GAA (0.62) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL17605918 0.95 GAA (0.58) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL24129831 0.91 GAA (0.52) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL27788871 0.83 GAA (0.57) GAAL3MBTL1EPHX1LMNAIDO1
SCHEMBL1200137 0.78 SIGMAR1 (0.61) GAAL3MBTL1LMNACYP3A4CYP2C19
SCHEMBL8437895 0.78 SIGMAR1 (0.61) GAAL3MBTL1LMNACYP3A4CYP2C19
SCHEMBL30763462 0.78 SIGMAR1 (0.61) GAAL3MBTL1LMNACYP3A4CYP2C19
SCHEMBL3749295 0.78 SIGMAR1 (0.61) GAAL3MBTL1LMNACYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4274878-A1 BASIC ASHLESS ADDITIVES AND LUBRICATING COMPOSITIONS CONTAINING SAME The Lubrizol Corporation (US) 2023-11-15 EP disclosed
WO-2022150464-A1 BASIC ASHLESS ADDITIVES AND LUBRICATING COMPOSITIONS CONTAINING SAME THE LUBRIZOL CORPORATION (US) 2022-07-14 WO disclosed
WO-2022150464-A1 BASIC ASHLESS ADDITIVES AND LUBRICATING COMPOSITIONS CONTAINING SAME THE LUBRIZOL CORPORATION (US) 2022-07-14 WO disclosed
CN-108440307-B Preparation method of chiral amine compound 浙江工业大学 2020-11-17 CN disclosed