SCHEMBL24620155

SCHEMBL24620155

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 3/20 0.51
▸ CTSC P53634 2/20 0.51
▸ ALK Q9UM73 7/20 0.50
▸ INSR P06213 3/20 0.50
▸ IGF1R P08069 3/20 0.50
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ MAP3K7 O43318 1/20 0.48
▸ MAP4K1 Q92918 1/20 0.48
▸ SLC2A1 P11166 1/20 0.48
▸ CCNK O75909 2/20 0.48
▸ CCND3 P30281 2/20 0.48
▸ CDK9 P50750 2/20 0.48
▸ CDK6 Q00534 2/20 0.48
▸ CCNA2 P20248 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ PTK2 Q05397 2/20 0.48
▸ AXL P30530 1/20 0.47

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
SCHEMBL30833021 1.00 EGFR (0.51) EGFRCTSCALKINSRIGF1R
SCHEMBL24620223 0.89 ALK (0.56) EGFRALKINSRIGF1RMAP3K7
SCHEMBL30833033 0.89 ALK (0.56) EGFRALKINSRIGF1RMAP3K7
SCHEMBL29791364 0.87 ALK (0.67) EGFRALKINSRIGF1RMAP3K7
SCHEMBL24620284 0.87 ALK (0.67) EGFRALKINSRIGF1RMAP3K7
SCHEMBL24620272 0.85 ALK (0.61) EGFRALKINSRIGF1RMAP3K7
SCHEMBL29791447 0.85 ALK (0.61) EGFRALKINSRIGF1RMAP3K7
SCHEMBL24620279 0.85 ALK (0.59) EGFRALKINSRIGF1RMAP3K7
SCHEMBL29791371 0.85 ALK (0.59) EGFRALKINSRIGF1RMAP3K7
SCHEMBL24620250 0.85 CCNK (0.66) EGFRCTSCALKMAP3K7SLC2A1

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 EGFR 1022/4885CTSC 2091/4885ALK 430/4885

“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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