SCHEMBL11277936

SCHEMBL11277936

Cn1c(=NN)sc2cc(OS(=O)(=O)O)ccc21

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KCNQ3 O43525 13/20 0.44
KCNQ2 O43526 13/20 0.44
THRB P10828 1/20 0.43
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL755192 0.79 TSHR (0.50) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL844791 0.76 ALDH1A1 (0.49) MAPTKDM4ESMN1; SMN2TP53POLB
Ammonia Solution, Strong SCHEMBL661471 0.75 ALDH1A1 (0.48) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4616442 0.75 MAPT (0.50) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4623298 0.75 MAPT (0.50) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4616325 0.73 RXFP1 (0.47) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4616566 0.73 RXFP1 (0.47) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4614701 0.73 RAB9A (0.57) MAPTKDM4ESMN1; SMN2TP53POLB
SCHEMBL4614704 0.73 RAB9A (0.57) MAPTKDM4ESMN1; SMN2TP53POLB
Water SCHEMBL1681829 0.72 RXFP1 (0.46) MAPTKDM4ESMN1; SMN2TP53POLB

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-0054679-A1 The use of reagent strips for the production of reagent solutions Roche Diagnostics GmbH (DE) 1982-06-30 EP disclosed