SCHEMBL19682272

SCHEMBL19682272

CSc1ccccc1ON

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC6A2 P23975 5/20 0.36
SLC6A4 P31645 5/20 0.36
SLC6A3 Q01959 3/20 0.36
AR P10275 1/20 0.36
IDO1 P14902 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
TDP1 Q9NUW8 3/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 3/20 0.35

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
SCHEMBL2774997 0.80 SLC6A2 (0.49) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL25820737 0.78 POLB (0.42) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL30514820 0.78 CA1 (0.57) POLBTSHRSMN1; SMN2HSD17B10AR
SCHEMBL71009 0.78 CA1 (0.57) POLBTSHRSMN1; SMN2HSD17B10AR
SCHEMBL9717743 0.76 SMN1; SMN2 (0.41) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL9717715 0.76 POLB (0.41) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL513843 0.76 POLB (0.41) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL29355812 0.76 POLB (0.41) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL3832622 0.74 POLB (0.40) POLBTSHRSMN1; SMN2HSD17B10SLC6A2
SCHEMBL27519450 0.74 POLB (0.40) POLBTSHRSMN1; SMN2HSD17B10SLC6A2

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
WO-2017208000-A1 ELECTROCHEMICAL PH SENSOR COMPRISING A PHENOLIC COMPOUND USING HYDROGEN BONDING OF THE HYDROXYL GROUP TO SULPHUR ATOMS OF THE PHENOLIC COMPOUND ANB SENSORS LIMITED (GB) 2017-12-07 WO disclosed