SCHEMBL6607488

SCHEMBL6607488

O=C1[CH]C(O)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
CDC25B P30305 2/20 0.39
IDO1 P14902 2/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
AKT1 P31749 1/20 0.39
SNCA P37840 1/20 0.39
MAP2K1 Q02750 1/20 0.39
PIN1 Q13526 1/20 0.39
EHMT2 Q96KQ7 1/20 0.39
NSD1 Q96L73 1/20 0.39
EHMT1 Q9H9B1 1/20 0.39
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
CYP2D6 P10635 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 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
SCHEMBL5078553 0.70 ALDH1A1 (0.46) ALDH1A1CDC25BIDO1MAOAMAOB
SCHEMBL16655976 0.68 ALDH1A1 (0.40) ALDH1A1IDO1MAOAMAOBEDNRB
SCHEMBL12854803 0.67 MEN1 (0.42) ALDH1A1CDC25BIDO1MAOAMAOB
SCHEMBL5436457 0.67 EDNRB (0.55) ALDH1A1CDC25BMAOAMAOBEDNRB
SCHEMBL15906510 0.67 CYP2D6 (0.47) ALDH1A1CDC25BMAOAMAOBEDNRB
SCHEMBL3994733 0.65 CYP2D6 (0.55) CDC25BIDO1EDNRBEDNRACYP2D6
SCHEMBL29503342 0.64 GPR3 (0.46) IDO1MAOAMAOBCYP2D6MEN1
SCHEMBL19590839 0.64 ALDH1A1 (0.42) ALDH1A1IDO1KDM4EMAPTRAB9A
SCHEMBL29884836 0.64 MAOA (0.52) ALDH1A1MAOAMAOBCYP2D6MEN1
SCHEMBL216862 0.64 MAOA (0.52) ALDH1A1MAOAMAOBCYP2D6MEN1

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
JP-2004295011-A PHOTOSENSITIVE COMPOSITION FUJI PHOTO FILM CO LTD 2004-10-21 JP disclosed