SCHEMBL16638661

SCHEMBL16638661

C=C(CC(=O)Oc1cccc2ccccc12)C(=O)OC1(CC)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
PGR P06401 1/20 0.42
GAA P10253 1/20 0.42
PTGS1 P23219 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
FAAH O00519 3/20 0.39
DRD2 P14416 3/20 0.39
CNR1 P21554 3/20 0.39
DRD3 P35462 3/20 0.39
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
MMP2 P08253 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
OGG1 O15527 1/20 0.35

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
SCHEMBL13554290 0.87 LMNA (0.34) HSD17B10GAAL3MBTL1KMT2ARAB9A
SCHEMBL13554309 0.84 CASP6 (0.33) ALDH1A1
SCHEMBL13555210 0.83 ALDH1A1 (0.33) ALDH1A1GAAMAPK1L3MBTL1KMT2A
SCHEMBL13554301 0.82 TTR (0.32)
SCHEMBL13554291 0.76 LMNA (0.37) ALDH1A1HSD17B10GAAL3MBTL1KMT2A
SCHEMBL18940871 0.75 NPSR1 (0.30)
SCHEMBL6516611 0.75 ALDH1A1 (0.46) ALDH1A1HSD17B10PGRGAAPTGS1
SCHEMBL13554307 0.75 TDP1 (0.36) ALDH1A1GAAL3MBTL1KMT2AKDM4E
SCHEMBL13554363 0.74 NPSR1 (0.33) GAA
SCHEMBL1402155 0.74 KDM4E (0.31) KDM4E

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-9005874-B2 Compound, polymeric compound, acid generator, resist composition, and method of forming resist pattern TOKYO OHKA KOGYO CO., LTD. (JP) 2015-04-14 US disclosed