SCHEMBL9769799

SCHEMBL9769799

CCC(C)(C)c1cc(OC(=O)c2ccccc2Oc2cc(C(C)(C)CC)cc(C(C)(C)CC)c2)cc(C(C)(C)CC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
ESR1 P03372 2/20 0.42
ESR2 Q92731 1/20 0.42
CYP2C9 P11712 6/20 0.41
CYP1A2 P05177 5/20 0.41
CYP2C19 P33261 4/20 0.41
CYP3A4 P08684 2/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
PTGS2 P35354 1/20 0.40
HSD17B10 Q99714 2/20 0.39

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
SCHEMBL10591307 0.87 NPSR1 (0.47) NPSR1MAPTTDP1L3MBTL1ESR1
SCHEMBL9769806 0.85 TDP1 (0.60) NPSR1MAPTTDP1L3MBTL1ESR1
SCHEMBL9769878 0.76 CYP1A2 (0.47) NPSR1MAPTL3MBTL1ESR1ESR2
SCHEMBL8373993 0.76 MAPT (0.57) NPSR1MAPTTDP1L3MBTL1ESR1
SCHEMBL5030952 0.74 NPC1 (0.58) NPSR1MAPTTDP1L3MBTL1ESR1
SCHEMBL9769889 0.74 NPSR1 (0.58) NPSR1MAPTTDP1L3MBTL1CYP2C9
SCHEMBL17175317 0.74 HTT (0.51) NPSR1MAPTTDP1ESR1ESR2
SCHEMBL5697818 0.74 MAPT (0.48) NPSR1MAPTTDP1L3MBTL1ESR1
SCHEMBL5929171 0.73 NPSR1 (0.78) NPSR1MAPTTDP1L3MBTL1CYP2C9
SCHEMBL9769816 0.71 MAPT (0.62) NPSR1MAPTTDP1L3MBTL1CYP2C9

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-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed