SCHEMBL30833033

SCHEMBL30833033

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 13/20 0.56
▸ INSR P06213 8/20 0.56
▸ IGF1R P08069 8/20 0.56
▸ EGFR P00533 5/20 0.56
▸ MAP3K7 O43318 1/20 0.54
▸ AXL P30530 1/20 0.52
▸ PTK2 Q05397 2/20 0.52
▸ JAK2 O60674 2/20 0.49
▸ SRC P12931 2/20 0.49
▸ CHEK1 O14757 1/20 0.49
▸ AURKA O14965 1/20 0.49
▸ NUAK1 O60285 1/20 0.49
▸ STK10 O94804 1/20 0.49
▸ PRKD3 O94806 1/20 0.49
▸ SLC34A2 O95436 1/20 0.49
▸ CHEK2 O96017 1/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ CD74 P04233 1/20 0.49
▸ ERBB2 P04626 1/20 0.49
▸ LCK P06239 1/20 0.49

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
SCHEMBL24620223 1.00 ALK (0.56) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620190 0.92 ALK (0.59) ALKEGFRPTK2
SCHEMBL29791364 0.91 ALK (0.67) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620284 0.91 ALK (0.67) ALKINSRIGF1REGFRMAP3K7
SCHEMBL29791447 0.90 ALK (0.61) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620272 0.90 ALK (0.61) ALKINSRIGF1REGFRMAP3K7
SCHEMBL29791371 0.89 ALK (0.59) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620279 0.89 ALK (0.59) ALKINSRIGF1REGFRMAP3K7
SCHEMBL24620155 0.89 EGFR (0.51) ALKINSRIGF1REGFRMAP3K7
SCHEMBL30833021 0.89 EGFR (0.51) ALKINSRIGF1REGFRMAP3K7

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
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

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.

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