SCHEMBL24620233

SCHEMBL24620233

CN1CCN(c2ccc(Nc3ncc(C(F)(F)F)c(Nc4cccc5c4C(=O)NC5)n3)c(OC(F)F)c2)CC1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 15/20 0.64
▸ EGFR P00533 2/20 0.53
▸ PTK2 Q05397 2/20 0.53
▸ ULK1 O75385 1/20 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
SCHEMBL30833032 1.00 ALK (0.64) ALKEGFRPTK2ULK1
SCHEMBL24620633 0.93 ALK (0.56) ALKEGFRPTK2ULK1
SCHEMBL30833015 0.93 ALK (0.56) ALKEGFRPTK2ULK1
SCHEMBL30833018 0.93 ALK (0.61) ALKEGFRULK1
SCHEMBL24620268 0.93 ALK (0.61) ALKEGFRULK1
SCHEMBL24620370 0.93 ALK (0.61) ALKEGFRPTK2ULK1
SCHEMBL30833050 0.93 ALK (0.61) ALKEGFRPTK2ULK1
SCHEMBL24620357 0.92 EGFR (0.63) ALKEGFRPTK2ULK1
SCHEMBL24620190 0.91 ALK (0.59) ALKEGFRPTK2
SCHEMBL24620213 0.91 ALK (0.54) ALKEGFRPTK2ULK1

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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