SCHEMBL9580305

SCHEMBL9580305

CC1(C)CC(N(N)C(=O)C(=O)NCCCCCCCCCCCCNC(=O)C(=O)N(N)C2CC(C)(C)N(Cc3ccccc3)C(C)(C)C2)CC(C)(C)N1Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
AMPD2 Q01433 3/20 0.37
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
EPHX2 P34913 3/20 0.35
KDM4E B2RXH2 1/20 0.35
ACHE P22303 2/20 0.35
PLAAT3 P53816 1/20 0.34
PLAAT5 Q96KN8 1/20 0.34
PLAAT2 Q9NWW9 1/20 0.34
PLAAT4 Q9UL19 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
DRD3 P35462 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
NAMPT P43490 1/20 0.34
EPHX1 P07099 1/20 0.34

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
SCHEMBL9580377 0.83 CYP3A4 (0.39) GAACYP3A4NAMPT
SCHEMBL27918827 0.78 AMPD2 (0.43) AMPD2UBE2MDCUN1D1
SCHEMBL9200819 0.72 GAA (0.37) GAAEPHX2
SCHEMBL9580344 0.72
SCHEMBL11098217 0.71 SLC2A1 (0.47) ACHE
SCHEMBL9149911 0.70 AMPD2 (0.36) AMPD2UBE2MDCUN1D1KDM4EACHE
SCHEMBL909996 0.69 AMPD2 (0.43) GAAAMPD2KDM4E
SCHEMBL909995 0.69 AMPD2 (0.43) GAAAMPD2KDM4E
SCHEMBL11131361 0.69 LMNA (0.41) AMPD2UBE2MDCUN1D1KDM4E
SCHEMBL9002880 0.69 GAA (0.47) GAAAMPD2EPHX2KDM4EEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5213897-A Curable coating compositions containing an N-(2,2,6,6-tetraalkyl-4-piperidinyl)amic acid hydrazide ELF ATOCHEM NORTH AMERICA, INC. 1993-05-25 US disclosed