SCHEMBL23586154

SCHEMBL23586154

COC(=O)c1c[nH]c(Cc2ccc(N=O)cc2)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RNASEH1 O60930 1/20 0.41
AR P10275 1/20 0.38
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KMT2A Q03164 1/20 0.35
HTT P42858 1/20 0.34
PDE2A O00408 3/20 0.32
PARP1 P09874 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
AOC3 Q16853 1/20 0.32

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
SCHEMBL15948066 0.86 SMN1; SMN2 (0.43) RNASEH1ARALDH1A1HPGDSMN1; SMN2
SCHEMBL15662204 0.84 RNASEH1 (0.40) RNASEH1ARALDH1A1HPGDSMN1; SMN2
SCHEMBL20477326 0.83 RNASEH1 (0.53) RNASEH1ALDH1A1HPGDSMN1; SMN2NPSR1
SCHEMBL16669003 0.80 MEN1 (0.43) RNASEH1ARSMN1; SMN2KMT2AHTT
SCHEMBL19780485 0.74 MAPK1 (0.40) ALDH1A1NPSR1KMT2AHTTKDM4E
SCHEMBL7425208 0.74 MAPK1 (0.40) ALDH1A1NPSR1KMT2AKDM4EMAPT
SCHEMBL1966536 0.72 PDE3B (0.48) ALDH1A1SMN1; SMN2NPSR1KMT2AHTT
SCHEMBL30392579 0.71 NPSR1 (0.47) ALDH1A1NPSR1PARP1GAA
SCHEMBL949159 0.71 MMP2 (0.56) RNASEH1ALDH1A1KMT2AKDM4EGAA
SCHEMBL27884838 0.71 NPSR1 (0.44) ALDH1A1HPGDSMN1; SMN2NPSR1KDM4E

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-3842420-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners LLC (US) 2021-06-30 EP disclosed