SCHEMBL20125070

SCHEMBL20125070

COC(CC1CO1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
CHRM2 P08172 6/20 0.42
CHRM4 P08173 6/20 0.42
CHRM5 P08912 6/20 0.42
CHRM1 P11229 6/20 0.42
CHRM3 P20309 6/20 0.42
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
EPHX1 P07099 1/20 0.39
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
APOBEC3A P31941 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36

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
SCHEMBL18531113 1.00 TDP1 (0.43) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL4464586 0.87 TDP1 (0.44) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL15247429 0.84 TDP1 (0.42) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9721607 0.82 AOC3 (0.50) ALDH1A1GLA
SCHEMBL334612 0.79 KMT2A (0.38) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL5495958 0.78 TDP1 (0.45) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL52157 0.77 TAAR1 (0.53) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL3117376 0.76 TDP1 (0.44) TDP1CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL19405689 0.75 TDP1 (0.42) TDP1CHRM2CHRM4CHRM5CHRM1
SCHEMBL51950 0.74 TAAR1 (0.55) TDP1CHRM2CHRM4CHRM5CHRM1

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
EP-2491926-B1 Treatment of protein degradation disorders HARVARD COLLEGE (US) 2018-05-09 EP disclosed