SCHEMBL5806397

SCHEMBL5806397

N#Cc1c(NC(=O)CS)sc2c1CCCC2

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.74
RAB9A P51151 4/20 0.74
SMN1; SMN2 Q16637 3/20 0.74
POLB P06746 2/20 0.72
MEN1 O00255 4/20 0.70
KMT2A Q03164 4/20 0.70
NPC1 O15118 3/20 0.70
LMNA P02545 1/20 0.70
KDM4E B2RXH2 1/20 0.70
MAPT P10636 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
USP2 O75604 1/20 0.69
MAPK1 P28482 1/20 0.69
ATM Q13315 1/20 0.69
GAA P10253 1/20 0.68
ESR2 Q92731 3/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
HTT P42858 1/20 0.67

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
SCHEMBL5804325 0.99 ALDH1A1 (0.76) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL5805290 0.97 ALDH1A1 (0.70) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL6248815 0.87 MEN1 (0.81) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL6246144 0.86 MEN1 (0.83) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL11369250 0.86 ALDH1A1 (0.97) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL5806395 0.86 ALDH1A1 (0.74) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL5804321 0.85 ALDH1A1 (0.76) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL6247335 0.84 ALDH1A1 (0.71) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL6246194 0.84 MEN1 (0.76) ALDH1A1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL11373858 0.84 MEN1 (0.97) ALDH1A1RAB9ASMN1; SMN2POLBMEN1

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-2006093518-A2 THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS APATH, LLC (US) 2006-09-08 WO disclosed