SCHEMBL700127

SCHEMBL700127

CC(=O)Nc1ncc(/C=C2\S/C(=N\c3ccccc3C(C)C)NC2=O)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.42
GSK3B P49841 1/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TUBB4A P04350 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40
TUBB4B P68371 1/20 0.40
TUBB3 Q13509 1/20 0.40
TUBB2A Q13885 1/20 0.40
TUBB8 Q3ZCM7 1/20 0.40
TUBA3E Q6PEY2 1/20 0.40
TUBA1A Q71U36 1/20 0.40
TUBA1C Q9BQE3 1/20 0.40
TUBB6 Q9BUF5 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
SCHEMBL700128 1.00 NPSR1 (0.42) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL651181 0.89 MEN1 (0.43) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL651180 0.89 MEN1 (0.43) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL650417 0.89 DYRK3 (0.48) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL650418 0.89 DYRK3 (0.48) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL651553 0.86 MEN1 (0.55) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL651554 0.86 MEN1 (0.55) NPSR1GSK3BMAPTMEN1KMT2A
SCHEMBL651590 0.85 NPC1 (0.54) GSK3BMAPTMEN1KMT2ATDP1
SCHEMBL649125 0.85 NPC1 (0.54) GSK3BMAPTMEN1KMT2ATDP1
SCHEMBL650934 0.85 MAPT (0.56) NPSR1GSK3BMAPTMEN1KMT2A

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-2423204-A1 THIAZOLIDINONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2012-02-29 EP disclosed