SCHEMBL18352197

SCHEMBL18352197

CCCCCOC1OC(C)C(O)CC1O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 4/20 0.41
▸ MAPK1 P28482 1/20 0.37
▸ CHRM5 P08912 2/20 0.36
▸ CHRM1 P11229 2/20 0.36
▸ CHRM3 P20309 2/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ TNF P01375 1/20 0.34
▸ PPP5C P53041 1/20 0.33
▸ GJB2 P29033 1/20 0.33

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
SCHEMBL19669024 0.98 GBA1 (0.43) GBA1MAPK1CHRM5CHRM1CHRM3
SCHEMBL18352198 0.98 GBA1 (0.43) GBA1MAPK1CHRM5CHRM1CHRM3
SCHEMBL22769140 0.88 CHRM5 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL16157294 0.88 CHRM5 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL16145424 0.81 ALDH1A1 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL16154497 0.81 ALDH1A1 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL16157280 0.81 CHRM5 (0.33) MAPK1CHRM5CHRM1CHRM3CHRM2
SCHEMBL14704264 0.81 ALDH1A1 (0.39) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL14704213 0.80 TK1 (0.43) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL24721233 0.80 ALDH1A1 (0.41) TSHRALDH1A1TDP1

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-9534008-B2 Small molecule compounds that control plant- and insect-pathogenic nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2017-01-03 — — US disclosed
Send feedback