SCHEMBL16021379

SCHEMBL16021379

CC1CC2CC1CC2C(=O)OCC(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 2/20 0.32
NR1H2 P55055 1/20 0.32
GAA P10253 3/20 0.32
KMT2A Q03164 3/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 4/20 0.32
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 2/20 0.30
MAPT P10636 1/20 0.30
NFKB1 P19838 1/20 0.30
MAPK1 P28482 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 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
SCHEMBL14169407 0.81 MAPK1 (0.38) NR1H2MAPK1
SCHEMBL15962037 0.81 POLB (0.31) POLBALDH1A1KDM4ENR1H2GAA
SCHEMBL32688683 0.79 POLB (0.41) POLBALDH1A1KMT2AHPGDL3MBTL1
SCHEMBL11941705 0.76 KDM4E (0.31) ALDH1A1KDM4E
SCHEMBL13893363 0.76 POLB (0.31) POLBALDH1A1KDM4EL3MBTL1
SCHEMBL14428634 0.74 NR1H2 (0.30) NR1H2
SCHEMBL29277637 0.73 NPC1 (0.42) ALDH1A1KDM4EGAAKMT2AHPGD
SCHEMBL30209840 0.73 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL14534948 0.72
SCHEMBL14428633 0.72 TSHR (0.36) POLBKMT2AL3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9519213-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-12-13 US disclosed
US-20140255843-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-11 US disclosed