SCHEMBL11075893

SCHEMBL11075893

COC(=O)CCC(=O)c1c(-c2ccccc2)cc2ccccn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.58
SMN1; SMN2 Q16637 5/20 0.55
L3MBTL1 Q9Y468 5/20 0.55
MAPT P10636 9/20 0.52
HTT P42858 6/20 0.52
ALDH1A1 P00352 8/20 0.50
TDP1 Q9NUW8 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
LMNA P02545 3/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.41
GAA P10253 2/20 0.40
ALOX12 P18054 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL11074803 0.85 SMN1; SMN2 (0.58) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11185924 0.82 L3MBTL1 (0.46) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11195982 0.81 THRB (0.60) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11076535 0.81 L3MBTL1 (0.46) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11081956 0.80 SMN1; SMN2 (0.52) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11075577 0.79 L3MBTL1 (0.60) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11189760 0.78 MAPT (0.51) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11080433 0.78 L3MBTL1 (0.49) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11071349 0.78 L3MBTL1 (0.49) THRBSMN1; SMN2L3MBTL1MAPTHTT
SCHEMBL11079931 0.78 L3MBTL1 (0.49) THRBSMN1; SMN2L3MBTL1MAPTHTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0043858-B1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1984-04-18 EP disclosed
US-4386092-A IMMUNOMODULATORY YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1983-05-31 US disclosed
EP-0043858-A1 HETERO RING-SUBSTITUTED OXOALKANOIC ACID DERIVATIVES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1982-01-20 EP disclosed