SCHEMBL30103482

SCHEMBL30103482

CSc1ccnc(C#N)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.40
CTSK P43235 3/20 0.39
TSHR P16473 2/20 0.34
ALDH1A1 P00352 2/20 0.32
GPR119 Q8TDV5 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
USP2 O75604 1/20 0.30
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL28040173 1.00 KMO (0.40) KMOCTSKTSHRALDH1A1GPR119
SCHEMBL18948551 0.80 CSNK1D (0.31)
SCHEMBL109350 0.77
SCHEMBL30362276 0.77
SCHEMBL5576942 0.70 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL8807337 0.70
SCHEMBL2238411 0.70 KMO (0.44) KMOCTSK
SCHEMBL24309289 0.68
SCHEMBL29921135 0.68
SCHEMBL7314558 0.68

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-4097138-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS Avila Therapeutics, Inc. (US) 2022-12-07 EP disclosed