SCHEMBL11051510

SCHEMBL11051510

CCCCNS(=O)(=O)c1ccc(C)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
HTT P42858 2/20 0.61
TSHR P16473 2/20 0.61
MEN1 O00255 1/20 0.61
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 1/20 0.46
CA12 O43570 2/20 0.43
CA9 Q16790 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX12 P18054 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL4715815 0.94 KMT2A (0.71) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL4716454 0.78 TSHR (0.43) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL4715407 0.76 SMN1; SMN2 (0.69) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL4715813 0.76 KMT2A (0.69) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL11053416 0.75 HTT (0.49) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL1853154 0.74 KMT2A (0.66) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL498607 0.74 TSHR (0.51) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL1164461 0.73 CYP2D6 (0.74) KMT2ATSHRMEN1ALDH1A1LMNA
SCHEMBL4721776 0.73 KMT2A (0.50) KMT2ASMN1; SMN2HTTTSHRMEN1
SCHEMBL12630271 0.72 KMT2A (0.47) KMT2ASMN1; SMN2HTTMEN1ALDH1A1

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-4430355-A ARTIFICIAL SWEETENER DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 US disclosed