SCHEMBL705541

SCHEMBL705541

Cc1ccc(N=NC=c2[nH]c(=O)c(=Cc3cnc(C(C)(C)C)s3)s2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.36
MAPT P10636 4/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
GAA P10253 2/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
RECQL P46063 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL705540 1.00 NPSR1 (0.36) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL710607 0.87 MAPT (0.34) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL710608 0.87 MAPT (0.34) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL709596 0.78 MEN1 (0.31) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL709595 0.78 MEN1 (0.31) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL704811 0.74 MEN1 (0.33) MAPTLMNAMEN1KMT2APOLB
SCHEMBL704812 0.74 MEN1 (0.33) MAPTLMNAMEN1KMT2APOLB
SCHEMBL702579 0.73 OGA (0.39) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL649184 0.71 MAPT (0.59) NPSR1MAPTLMNAMEN1KMT2A
SCHEMBL649185 0.71 MAPT (0.59) NPSR1MAPTLMNAMEN1KMT2A

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