SCHEMBL24620308

SCHEMBL24620308

COc1c(Nc2ncc(Cl)c(Nc3cccc4c3C(=O)NC4)n2)ccc(N2C[C@H]3CN(C)C[C@H]3C2)c1F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 15/20 0.43
▸ INSR P06213 7/20 0.43
▸ IGF1R P08069 4/20 0.42
▸ EGFR P00533 2/20 0.42
▸ AXL P30530 1/20 0.41
▸ MAP3K7 O43318 1/20 0.41
▸ ROS1 P08922 2/20 0.41
▸ MAP4K1 Q92918 2/20 0.40

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
SCHEMBL30833022 1.00 ALK (0.43) ALKINSRIGF1REGFRAXL
SCHEMBL24620341 0.91 ALK (0.42) ALKEGFRMAP4K1
SCHEMBL29791462 0.87 ALK (0.56) ALKINSRIGF1REGFRROS1
SCHEMBL24620243 0.87 ALK (0.56) ALKINSRIGF1REGFRROS1
SCHEMBL29791355 0.85 ALK (0.46) ALKINSRIGF1REGFR
SCHEMBL24620283 0.85 ALK (0.46) ALKINSRIGF1REGFR
SCHEMBL30833028 0.81 ALK (0.54) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620312 0.81 ALK (0.54) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620318 0.81 ALK (0.54) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620285 0.80 ALK (0.46) ALKINSRIGF1REGFRMAP4K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240092763-A1 ISOINDOLINONE AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF NUAK KINASES, COMPOSITIONS AND USES THEREOF SINAI HEALTH SYSTEM (CA) 2024-03-21 — — US claimed
US-20240092763-A1 ISOINDOLINONE AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF NUAK KINASES, COMPOSITIONS AND USES THEREOF SINAI HEALTH SYSTEM (CA) 2024-03-21 — — US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240092763-A1 ISOINDOLINONE AMINOPYRIMIDINE COMPOUNDS AS INHIBITORS OF NUAK KINASES, COMPOSITIONS AND USES THEREOF NUAK1, NUAK2, NEK1 ALK 430/4885INSR 1031/4885IGF1R 1204/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback