SCHEMBL5309261

SCHEMBL5309261

COC(=O)c1sccc1NC(=O)CCc1ccc(-c2ccccn2)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.60
MAPK8 P45983 8/20 0.57
MAPK10 P53779 8/20 0.57
MAPK9 P45984 4/20 0.55
ALDH1A1 P00352 1/20 0.53
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.50
HPGD P15428 1/20 0.50
CASP3 P42574 1/20 0.50
ATM Q13315 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL5292909 0.89 HCAR2 (0.69) HCAR2MAPK8MAPK10ALDH1A1KMT2A
SCHEMBL5303546 0.86 MAPK8 (0.66) HCAR2MAPK8MAPK10MAPK9HTT
SCHEMBL5301445 0.84 RAB9A (0.70) HCAR2ALDH1A1SMN1; SMN2L3MBTL1KMT2A
SCHEMBL14609699 0.82 HCAR2 (0.64) HCAR2MAPK8MAPK10MAPK9ALDH1A1
SCHEMBL5330467 0.80 KMT2A (0.60) MAPK8MAPK10MAPK9ALDH1A1HTT
SCHEMBL5292231 0.79 LMNA (0.57) MAPK8MAPK10MAPK9ALDH1A1HTT
SCHEMBL5301746 0.79 KMT2A (0.77) MAPK8MAPK10MAPK9ALDH1A1HTT
SCHEMBL5292551 0.79 POLB (0.61) MAPK8MAPK10MAPK9ALDH1A1HTT
SCHEMBL5303540 0.79 SMN1; SMN2 (0.54) MAPK8MAPK10MAPK9ALDH1A1HTT
SCHEMBL4749274 0.78 SMN1; SMN2 (0.56) MAPK8MAPK10MAPK9ALDH1A1SMN1; SMN2

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-2007015744-A1 DISUBSTITUTED THIENYL COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2007-02-08 WO disclosed