SCHEMBL29914510

SCHEMBL29914510

Nc1ncccc1-c1cc2c(cn1)C(=O)NCC2

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 11/20 0.47
PARP11 Q9NR21 8/20 0.47
PARP1 P09874 8/20 0.47
PDPK1 O15530 1/20 0.47
MAPK1 P28482 1/20 0.45
GRM5 P41594 1/20 0.41
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
PIM1 P11309 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39

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
SCHEMBL29750194 0.82 PARP11 (0.59) PARP10PARP11PARP1PDPK1MAPK1
SCHEMBL29964432 0.81 PARP10 (0.44) PARP10PARP11PARP1PDPK1MAPK1
SCHEMBL29914493 0.81 PARP10 (0.48) PARP10PARP11PARP1PDPK1MAPK1
SCHEMBL24681233 0.81 PARP10 (0.48) PARP10PARP11PARP1PDPK1MAPK1
SCHEMBL12495886 0.78 PARP10 (0.48) PARP10PARP11PARP1MAPK1GRM5
SCHEMBL18937006 0.76 MAP4K4 (0.50) PARP10PARP11MAPK1GRM5
SCHEMBL29963884 0.76 PARP10 (0.42) PARP10PARP11PARP1MAPK1GRM5
SCHEMBL12077063 0.75 PARP10 (0.41) PARP10PARP11PARP1PDPK1MAPK1
SCHEMBL24680918 0.72 FYN (0.57) PARP1MAPK1
SCHEMBL12496236 0.71 GABRG2 (0.47) PARP10PARP11PARP1MAPK1GRM5

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
WO-2022226667-A1 SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 WO disclosed