SCHEMBL9550378

SCHEMBL9550378

COC(=O)Cc1cccc2cc(C(=O)c3ccc(OC)cc3)oc12

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.67
ALDH1A1 P00352 4/20 0.67
MAPT P10636 4/20 0.67
NPC1 O15118 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HTT P42858 1/20 0.67
KMT2A Q03164 6/20 0.53
MEN1 O00255 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 2/20 0.42
RECQL P46063 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
MCL1 Q07820 1/20 0.41

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
SCHEMBL9550494 0.81 NTRK1 (0.53) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL9550370 0.75 HDAC3 (0.53) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
Water SCHEMBL28757486 0.75 NPC1 (0.47) RAB9AALDH1A1MAPTNPC1HTT
SCHEMBL8761540 0.73 MAPT (0.72) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL9550442 0.72 MAOA (0.51) RAB9AALDH1A1NPC1KMT2AMEN1
SCHEMBL2862203 0.71 CYP2D6 (0.54) RAB9AALDH1A1MAPTNPC1HTT
SCHEMBL15509773 0.71 MTNR1A (0.64) L3MBTL1TDP1
SCHEMBL2859379 0.70 SLC5A1 (0.50) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL5723065 0.70 RAB9A (1.00) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL11107533 0.69 RAB9A (0.79) RAB9AALDH1A1MAPTNPC1SMN1; SMN2

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-5182295-A Miticides, fungicides ROUSSEL UCLAF (FR) 1993-01-26 US disclosed