SCHEMBL8782017

SCHEMBL8782017

CCOC(=O)C1=CC=CC2S[C]CC12

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.32
GAA P10253 5/20 0.32
HPGD P15428 5/20 0.32
HSD17B10 Q99714 3/20 0.32
POLB P06746 3/20 0.32
KDM4E B2RXH2 2/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 3/20 0.32
HTT P42858 2/20 0.31
KMT2A Q03164 3/20 0.30
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA7 P43166 3/20 0.30
CA9 Q16790 3/20 0.30
CA14 Q9ULX7 3/20 0.30
MAPT P10636 3/20 0.30

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
SCHEMBL8781822 0.76 TSHR (0.34) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL16349333 0.70 LMNA (0.42) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL12723239 0.67 TSHR (0.39) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL817737 0.64 ALDH1A1 (0.38) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL817874 0.62 TSHR (0.37) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL11796042 0.60 TSHR (0.45) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL12723240 0.60 ADORA2B (0.37) POLBKDM4ETDP1L3MBTL1TSHR
SCHEMBL818261 0.60 CYP1A2 (0.36) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL21776592 0.60 LMNA (0.43) ALDH1A1GAAHPGDHSD17B10POLB
SCHEMBL15929799 0.60 KDM4E (0.39) ALDH1A1GAAHPGDHSD17B10KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643925-A COGNITION ACTIVATORS AND NERVE GROWTH FACTORS SANKYO COMPANY, LIMITED (JP) 1997-07-01 US disclosed
US-5614521-A NERVE GROWTH FACTOR SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
EP-0501656-B1 New benzene derivatives having (NGF) production-promoting activity SANKYO CO (JP) 1997-01-22 EP disclosed
EP-0501656-A2 New benzene derivatives having (NGF) production-promoting activity Sankyo Company Limited (JP) 1992-09-02 EP disclosed