SCHEMBL10653085

SCHEMBL10653085

Nc1c2c(nc3ccc(F)cc13)CCCS2

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 17/20 0.63
BCHE P06276 12/20 0.63
GRIN1 Q05586 12/20 0.63
GRIN2A Q12879 12/20 0.63
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL10653161 0.89 ACHE (0.63) ACHEBCHEGRIN1GRIN2AKMT2A
SCHEMBL10654149 0.83 ACHE (0.65) ACHEBCHEGRIN1GRIN2A
SCHEMBL10651068 0.83 ACHE (0.63) ACHEBCHEGRIN1GRIN2A
SCHEMBL10651833 0.82 ACHE (0.41) ACHEBCHEGRIN1GRIN2A
SCHEMBL9172013 0.80 ACHE (0.66) ACHEBCHEGRIN1GRIN2AALDH1A1
SCHEMBL9209834 0.79 ACHE (0.59) ACHEBCHEGRIN1GRIN2AALDH1A1
SCHEMBL9736799 0.79 ACHE (0.69) ACHEBCHEALDH1A1
SCHEMBL10650942 0.78 ACHE (0.41) ACHEBCHEGRIN1GRIN2A
SCHEMBL8018131 0.78 ACHE (1.00) ACHEBCHEGRIN1GRIN2A
SCHEMBL8015465 0.78 ACHE (1.00) ACHEBCHEGRIN1GRIN2AALDH1A1

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-0268871-A1 Quinoline derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-06-01 EP disclosed