SCHEMBL9697385

SCHEMBL9697385

CCCCC(=O)N(C)N1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPT P10636 2/20 0.39
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
POLB P06746 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.34
KDM4E B2RXH2 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
Hydrochloric Acid SCHEMBL9697236 0.98 ALDH1A1 (0.48) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL4591978 0.80 L3MBTL1 (0.34) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL4592224 0.78 L3MBTL1 (0.32) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL7438590 0.72 ALDH1A1 (0.38) ALDH1A1L3MBTL1MAPTPOLBLMNA
SCHEMBL6248599 0.71 ALDH1A1 (0.42) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL6632132 0.71 ALDH1A1 (0.36) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL11469221 0.69 CHRM2 (0.33)
SCHEMBL27453240 0.69 SIGMAR1 (0.43) ALDH1A1L3MBTL1MEN1KMT2ATDP1
SCHEMBL11446827 0.69 SIGMAR1 (0.49) ALDH1A1SIGMAR1KDM4E
SCHEMBL4592349 0.69 CHRM2 (0.37) ALDH1A1MEN1KMT2ATDP1MAPT

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
WO-1992003415-A1 PROTEIN KINASE C MODULATORS NOVA PHARMACEUTICAL CORPORATION (US) 1992-03-05 WO disclosed