SCHEMBL8419296

SCHEMBL8419296

CC(CC1CO1)C(CC1CO1)(c1ccccc1O)c1ccccc1O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CHRM2 P08172 2/20 0.30
CHRM4 P08173 2/20 0.30
CHRM5 P08912 2/20 0.30
CHRM1 P11229 2/20 0.30
CHRM3 P20309 2/20 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
SCHEMBL7721987 0.75 TSHR (0.47) TSHRALDH1A1TDP1CHRM2CHRM4
SCHEMBL6551063 0.75 APOBEC3A (0.30)
SCHEMBL5599148 0.74 NPC1 (0.31) ALDH1A1
SCHEMBL27436357 0.68 MEN1 (0.41) ALDH1A1TDP1CHRM2CHRM4CHRM5
SCHEMBL10658044 0.67 GAA (0.35)
SCHEMBL2266770 0.67 ALDH1A1 (0.44) TSHRALDH1A1TDP1
Propylene Oxide SCHEMBL27795211 0.66 ALDH1A1 (0.52) TSHRALDH1A1TDP1
SCHEMBL3106376 0.66 TSHR (0.56) TSHRALDH1A1TDP1
SCHEMBL17437817 0.66 MEN1 (0.46) TSHRALDH1A1TDP1
SCHEMBL28487216 0.66 ALDH1A1 (0.30) ALDH1A1

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-5962586-A Epoxy resin(s) with anhydride and polybutadiene-maleic anhydride adduct HARPER JOHN D (US) 1999-10-05 US disclosed
US-5629379-A Anhydride-hardened epoxy resin with polybutadiene-maleic anhydride adduct HARPER JOHN D (US) 1997-05-13 US disclosed