SCHEMBL20568616

SCHEMBL20568616

NC(=O)c1nccc(-c2ccc3c(c2)C=CCN3)c1N

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTK Q06187 3/20 0.32
LCK P06239 2/20 0.32
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
PRKCI P41743 1/20 0.32
FYN P06241 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
IKBKB O14920 2/20 0.31
CHUK O15111 2/20 0.31
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
NUDT1 P36639 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
SCHEMBL20568614 0.83 MKNK1 (0.32) MKNK1MKNK2
SCHEMBL20568277 0.72 ABL1 (0.34)
SCHEMBL27973449 0.70 TSHR (0.38) LCK
SCHEMBL26685289 0.69 BRAF (0.32)
SCHEMBL30688546 0.69 BRAF (0.32)
SCHEMBL23067311 0.69 MAP2K3 (0.50) BTKLCKMKNK1MKNK2FYN
SCHEMBL22418394 0.66 ADORA3 (0.36) LCK
SCHEMBL20568817 0.65 PRKACA (0.36)
Hydrochloric Acid SCHEMBL28292048 0.65 ADORA3 (0.35) LCK
SCHEMBL15882339 0.64 MKNK1 (0.42) BTKLCKMKNK1MKNK2PRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3630749-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 Cancer Research Technology Limited (GB) 2020-04-08 EP disclosed
WO-2018215798-A1 2-QUINOLONE DERIVED INHIBITORS OF BCL6 CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-11-29 WO disclosed