SCHEMBL11823932

SCHEMBL11823932

c1csc(OCC2CO2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 6/20 0.42
TSHR P16473 5/20 0.42
TP53 P04637 3/20 0.42
HIF1A Q16665 2/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PKM P14618 2/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
GLA P06280 1/20 0.40
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
PPARG P37231 1/20 0.38
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 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
SCHEMBL11824346 0.79
SCHEMBL28197543 0.77 CHRM2 (0.38) CHRM2CHRM1CHRM3
SCHEMBL6646476 0.74 CHRM2 (0.33) ALDH1A1TSHRCHRM2CHRM1CHRM3
SCHEMBL6648703 0.74 SYK (0.40) CHRM2CHRM1CHRM3
SCHEMBL10916885 0.73 TDP1 (0.50) TDP1ALDH1A1TSHRTP53HIF1A
SCHEMBL14527076 0.71 ADRA1A (0.53) TDP1ALDH1A1TSHRTP53HIF1A
SCHEMBL6647404 0.70 ACACB (0.32) CHRM2CHRM1CHRM3
SCHEMBL9294105 0.70 DRD4 (0.46) TDP1ALDH1A1TSHRTP53HIF1A
SCHEMBL9534864 0.69 ALDH1A1 (0.46) TDP1ALDH1A1TSHRTP53HIF1A
SCHEMBL14060929 0.68 TDP1 (0.53) TDP1ALDH1A1TSHRTP53HIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3982010-A Thiazole cardiovascular agents SYNTEX (U.S.A.) INC. (US) 1976-09-21 US disclosed
US-3982010-A Thiazole cardiovascular agents SYNTEX (U.S.A.) INC. (US) 1976-09-21 US disclosed
US-3896139-A PROCESS FOR PREPARING 3-(4-OR-5-AZIDOCARBONYLTHIAZOL-2-OXY)-PROPANEDIOL-1,2-ACETONIDES SYNTEX INC 1975-07-22 US disclosed