SCHEMBL7949769

SCHEMBL7949769

COc1ccc(CC(=O)OCC2(c3ccc(C)cc3OC(C)=O)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.51
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 3/20 0.42
ATM Q13315 1/20 0.42
GAA P10253 2/20 0.41
KLK7 P49862 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
MAPK10 P53779 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 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
SCHEMBL7951730 0.88 NPSR1 (0.40) L3MBTL1KMT2AALDH1A1KDM4ETDP1
SCHEMBL7953545 0.88 KMT2A (0.43) L3MBTL1KMT2AALDH1A1ATMNPSR1
SCHEMBL7949061 0.87 NPSR1 (0.56) L3MBTL1KMT2AALDH1A1MEN1KDM4E
SCHEMBL7948165 0.78 NPSR1 (0.51) L3MBTL1KMT2AALDH1A1KDM4ETDP1
SCHEMBL7949843 0.75 NPSR1 (0.57) L3MBTL1KMT2AALDH1A1KDM4ETDP1
SCHEMBL7953635 0.74 NPSR1 (0.59) L3MBTL1KMT2AALDH1A1ATMNPSR1
SCHEMBL7949795 0.72 L3MBTL1 (0.50) L3MBTL1KMT2AALDH1A1MEN1KDM4E
SCHEMBL7948105 0.72 NPSR1 (0.53) L3MBTL1KMT2AALDH1A1MEN1ATM
SCHEMBL7941805 0.71 NPSR1 (0.41) KMT2AALDH1A1ATMGAANPSR1
SCHEMBL31321675 0.71 L3MBTL1 (0.80) L3MBTL1KMT2AALDH1A1MEN1KDM4E

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-6255517-B1 6-SULFONYLOXYISOPROPENYL-M-CRESOL AND ESTERS Zee, Ok Pyo (KR) 2001-07-03 US disclosed