SCHEMBL9800985

SCHEMBL9800985

CCN1CCN(CCO)CC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 2/20 0.35
CHRM1 P11229 1/20 0.34
SLC29A1 Q99808 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
OPRL1 P41146 1/20 0.31
HSD11B1 P28845 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL9801204 0.89 SLC29A1 (0.37) CHRM1SLC29A1
SCHEMBL9801598 0.88 ALDH1A1 (0.38) ALDH1A1KDM4ESLC29A1KMT2AMEN1
SCHEMBL9801023 0.87 SLC29A1 (0.35) ALDH1A1KDM4ESLC29A1KMT2AMEN1
SCHEMBL7902209 0.84 HTR1A (0.33) CHRM1SLC29A1
SCHEMBL9801415 0.81 ALOX15 (0.37) ALDH1A1KDM4ESLC29A1KMT2AMEN1
SCHEMBL7903314 0.81 CHRM1 (0.35) CHRM1
SCHEMBL9801257 0.81 ALOX15 (0.44) CHRM1SLC29A1
SCHEMBL9801317 0.79 SLC29A1 (0.40) ALDH1A1KDM4ESLC29A1OPRL1
SCHEMBL9800998 0.79 SLC29A1 (0.38) ALDH1A1KDM4ESLC29A1
SCHEMBL9801699 0.78 KEAP1 (0.37) SLC29A1

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed