SCHEMBL28206372

SCHEMBL28206372

CCCOCCOCCOCCC.NC(=O)N(N)N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.34
TSHR P16473 3/20 0.33
ALDH1A1 P00352 3/20 0.33
ALOX15 P16050 1/20 0.33
NR1I2 O75469 1/20 0.33
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
CYP3A4 P08684 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
EPHX2 P34913 1/20 0.31
CES2 O00748 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL28833521 1.00 HSD17B10 (0.34) HSD17B10TSHRALDH1A1ALOX15NR1I2
SCHEMBL28183033 0.86 ALDH1A1 (0.48) HSD17B10TSHRALDH1A1ALOX15BLM
SCHEMBL28169515 0.83 ALDH1A1 (0.50) HSD17B10TSHRALDH1A1ALOX15THRB
SCHEMBL25733878 0.78 CES2 (0.40) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL22266204 0.78 CES2 (0.40) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL23875143 0.78 CES2 (0.40) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL2293384 0.78 CES2 (0.40) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL2287377 0.78 CES2 (0.40) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL15783570 0.76 CYP3A4 (0.38) HSD17B10TSHRALDH1A1ALOX15MEN1
SCHEMBL19969031 0.76 CYP3A4 (0.38) HSD17B10TSHRALDH1A1ALOX15MEN1

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
CN-107787337-A Aldimines and ketimines as initiators in curing agent systems and corresponding resin compositions, in particular for fixing technology 费希尔厂有限责任两合公司 2018-03-09 CN disclosed