SCHEMBL11259515

SCHEMBL11259515

CCCCCCCCOCCCN1CCN=C(C)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
GBA1 P04062 1/20 0.33
CHRM1 P11229 4/20 0.32
CHRM2 P08172 1/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
PLA2G2A P14555 1/20 0.31
PTGER4 P35408 1/20 0.31
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
LTA4H P09960 1/20 0.31
THRA P10827 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
SCHEMBL11264220 0.89 ALDH1A1 (0.51) THRBALDH1A1MAPTGAAGBA1
SCHEMBL11252637 0.89 ALDH1A1 (0.51) THRBALDH1A1MAPTGAAGBA1
SCHEMBL11259239 0.88 ALDH1A1 (0.36) THRBALDH1A1MAPTGAA
SCHEMBL11259234 0.82 ALDH1A1 (0.37) THRBALDH1A1MAPTGAA
SCHEMBL11257126 0.81 ALDH1A1 (0.49) THRBALDH1A1MAPTGAAGBA1
SCHEMBL11262663 0.80 DGKA (0.47) THRBALDH1A1MAPTGAAKMT2A
SCHEMBL11130692 0.79 ALDH1A1 (0.41) THRBALDH1A1MAPTGAA
SCHEMBL11128278 0.79 ALDH1A1 (0.41) THRBALDH1A1MAPTGAA
SCHEMBL11264796 0.79 ALDH1A1 (0.41) THRBALDH1A1MAPTGAA
SCHEMBL11259244 0.79 ALDH1A1 (0.35) THRBALDH1A1MAPTGAA

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-4346087-A CORROSION RESISTANCE TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 1982-08-24 US disclosed