SCHEMBL9613745

SCHEMBL9613745

CCOC(=O)Cn1c(=O)c(=O)[nH]c2cc(Cl)cc(Cl)c21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 5/20 0.42
GRIA2 P42262 5/20 0.42
GRIA3 P42263 5/20 0.42
GRIA4 P48058 5/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN1 Q05586 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2B Q13224 2/20 0.42
GRIN2C Q14957 2/20 0.42
GRIN3A Q8TCU5 2/20 0.42
ALDH1A1 P00352 3/20 0.42
PPARG P37231 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41

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
SCHEMBL8556947 0.82 GRIN2D (0.62) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7476480 0.81 ADORA3 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL10487991 0.73 ALDH1A1 (0.46) GRIN1GRIN2BALDH1A1PPARGSMN1; SMN2
SCHEMBL7484219 0.73 GRIA1 (0.61) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7477922 0.72 ADORA3 (0.52) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7486654 0.71 CYP1A2 (0.49) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL7488589 0.71 ADORA3 (0.44) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL9093498 0.71 ALDH1A1 (0.56) ALDH1A1APOBEC3AAPOBEC3GGSRMEN1
SCHEMBL7811625 0.71 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8191455 0.71 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D

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
US-5166155-A Neurological or psychiatric diseases NOVO NORDISK A/S (DK) 1992-11-24 US disclosed