SCHEMBL24620266

SCHEMBL24620266

O=C1NCc2cccc(Nc3nc(Nc4ccc(N5CCC6(CCNCC6)CC5)cc4OC(F)F)ncc3Cl)c21

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 17/20 0.62
▸ MAPK3 P27361 1/20 0.58
▸ EGFR P00533 3/20 0.51

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
SCHEMBL30833027 1.00 ALK (0.62) ALKMAPK3EGFR
SCHEMBL24620313 0.93 MAPK3 (0.66) ALKMAPK3EGFR
SCHEMBL30833043 0.93 MAPK3 (0.66) ALKMAPK3EGFR
SCHEMBL30833031 0.91 ALK (0.56) ALKMAPK3EGFR
SCHEMBL24620355 0.91 ALK (0.56) ALKMAPK3EGFR
SCHEMBL24620315 0.90 MAPK3 (0.63) ALKMAPK3EGFR
SCHEMBL29791417 0.90 MAPK3 (0.63) ALKMAPK3EGFR
SCHEMBL24620272 0.89 ALK (0.61) ALKMAPK3EGFR
SCHEMBL29791447 0.89 ALK (0.61) ALKMAPK3EGFR
SCHEMBL24620280 0.88 EGFR (0.60) ALKMAPK3EGFR

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-2022147622-A1 ISOINDOLINONE AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF NUAK KINASES, COMPOSITIONS AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-07-14 — — WO disclosed
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