SCHEMBL10403103

SCHEMBL10403103

COCc1nnc(SC([O])=O)s1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 5/20 0.44
TSHR P16473 5/20 0.43
ALDH1A1 P00352 7/20 0.42
HPGD P15428 4/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.40
BRD4 O60885 1/20 0.38
TP53 P04637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPT P10636 1/20 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
SCHEMBL10401989 0.83 TSHR (0.44) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL10402744 0.78 HSD17B10 (0.43) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL19369802 0.76 POLB (0.53) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL10769958 0.76 SMN1; SMN2 (0.36) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL10402745 0.74 HSD17B10 (0.43) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL19361775 0.71 POLB (0.48) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL10401935 0.71 POLB (0.44) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL9840251 0.70 POLB (0.47) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL8044327 0.69 RXRA (0.41) POLBSMN1; SMN2HSD17B10TSHRALDH1A1
SCHEMBL10403874 0.68 POLB (0.44) POLBSMN1; SMN2HSD17B10TSHRALDH1A1

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-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 US disclosed