SCHEMBL8606754

SCHEMBL8606754

COc1c(CC(=O)N2CCNCC2)cccc1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
RBP4 P02753 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALOX15 P16050 1/20 0.40
HPGD P15428 1/20 0.39
NR1H4 Q96RI1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
TPSAB1 Q15661 1/20 0.38
TPSD1 Q9BZJ3 1/20 0.38
TPSG1 Q9NRR2 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
SCHEMBL8607276 0.88 GAA (0.58) GAAKMT2AMEN1LMNAHPGD
SCHEMBL8606651 0.85 GAA (0.52) GAAKMT2ASIGMAR1RBP4HPGD
SCHEMBL8606860 0.83 GAA (0.48) GAASMN1; SMN2HPGDPKM
SCHEMBL8609160 0.80 GAA (0.49) GAAKMT2ASMN1; SMN2MAPTHTT
SCHEMBL8608905 0.79 ALDH1A1 (0.50) GAALMNAHTTSIGMAR1HPGD
SCHEMBL8608709 0.78 GAA (0.48) GAAKMT2ASMN1; SMN2MAPTTSHR
SCHEMBL3624308 0.77 KMT2A (0.69) KMT2AMEN1SMN1; SMN2LMNAMAPT
SCHEMBL7792463 0.76 NR1H4 (0.55) NR1H4
SCHEMBL8608693 0.76 GAA (0.46) GAAKMT2ASMN1; SMN2MAPTHTT
SCHEMBL8635182 0.75 GAA (0.60) GAAKMT2AMEN1SMN1; SMN2MAPT

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-5847187-A Organic phosphorous compound, a process for producing the same and a use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-12-08 US disclosed