SCHEMBL15865743

SCHEMBL15865743

CC(C)(C)NC(=O)C1CCCN(C(=O)C2CCCN(C(=O)C(C)(C)C)C2)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DUSP22 Q9NRW4 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
POLB P06746 1/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.37
LMNA P02545 3/20 0.37

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
SCHEMBL2757957 0.88 HPGD (0.50) DUSP22SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL16095734 0.81 LMNA (0.45) DUSP22SMN1; SMN2KMT2AMEN1POLB
SCHEMBL2757960 0.81 MAPK8 (0.43) DUSP22SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL14679331 0.81 BCHE (0.47) MAPTKMT2AMEN1POLBMMP1
SCHEMBL2757938 0.77 MEN1 (0.48) DUSP22KMT2AMEN1ALDH1A1LMNA
SCHEMBL11922670 0.77 ALDH1A1 (0.52) ALDH1A1HPGDLMNA
SCHEMBL13701692 0.76 KMT2A (0.59) SMN1; SMN2MAPTKMT2AMEN1POLB
SCHEMBL21097019 0.76 DUSP22 (0.40) DUSP22KMT2AMEN1POLBLMNA
SCHEMBL21097023 0.76 DUSP22 (0.40) DUSP22KMT2AMEN1POLBLMNA
SCHEMBL28447168 0.76 ALDH1A1 (0.46) SMN1; SMN2MAPTKMT2AMEN1ALDH1A1

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-8772450-B2 Beta-amino acids WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-07-08 US disclosed