SCHEMBL7863602

SCHEMBL7863602

CCN(CC)c1ccc(C=O)c(OC(=O)C(C)(C)C)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
MAPT P10636 8/20 0.42
KDM4E B2RXH2 6/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 1/20 0.41
BACE1 P56817 4/20 0.41
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CNR2 P34972 1/20 0.39
ELANE P08246 4/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38

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
SCHEMBL9361815 0.84 ALDH1A1 (0.70) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL28338105 0.81 ALDH1A1 (0.65) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL2950989 0.79 ALDH1A1 (1.00) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL1646997 0.78 ALDH1A1 (0.62) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL5146907 0.78 ALDH1A1 (0.74) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL11864011 0.77 ALDH1A1 (0.63) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL8415573 0.76 ALDH1A1 (0.56) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL20883002 0.76 ALDH1A1 (0.67) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL3224984 0.76 ALDH1A1 (0.67) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT
SCHEMBL5556090 0.76 ALDH1A1 (0.62) ALDH1A1L3MBTL1ALDH3A1ALDH1A3MAPT

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-6197968-B1 STORAGE STABILITY; COLORLESS AFTER SOLUTION TREATMENT FUJI PHOTO FILM CO., LTD. (JP) 2001-03-06 US disclosed