SCHEMBL23150443

SCHEMBL23150443

Nc1ncnc2c1c(I)nn2-c1cc(N2CCN(C(=O)O)CC2)ncn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.42
▸ JAK3 P52333 2/20 0.42
▸ EGFR P00533 2/20 0.42
▸ MAP4K4 O95819 3/20 0.40
▸ DYRK3 O43781 2/20 0.40
▸ CDK1 P06493 2/20 0.40
▸ ROS1 P08922 2/20 0.40
▸ RPS6KB1 P23443 2/20 0.40
▸ CDK2 P24941 2/20 0.40
▸ CSNK1A1 P48729 2/20 0.40
▸ CSNK1D P48730 2/20 0.40
▸ CLK2 P49760 2/20 0.40
▸ IRAK1 P51617 2/20 0.40
▸ CDK5 Q00535 2/20 0.40
▸ DYRK1A Q13627 2/20 0.40
▸ NTRK3 Q16288 2/20 0.40
▸ SLK Q9H2G2 2/20 0.40
▸ CLK4 Q9HAZ1 2/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ PLK4 O00444 1/20 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
SCHEMBL20553506 0.85 MAP4K4 (0.52) JAK2JAK3EGFRMAP4K4SRC
SCHEMBL30406029 0.82 MAPT (0.37) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL23150477 0.76 MTOR (0.54) PIK3CD
SCHEMBL20445971 0.75 KMO (0.44) MAP4K4KDRLIMK1LOXL2KMO
SCHEMBL30405599 0.73 SRC (0.42) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL20553262 0.73 SRC (0.42) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL5802174 0.72 JAK2 (0.67) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL27586600 0.71 JAK2 (0.42) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL15648870 0.71 SRC (0.65) JAK2JAK3EGFRMAP4K4DYRK3
SCHEMBL23150464 0.70 JAK3 (0.59) JAK2JAK3EGFRMAP4K4DYRK3

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
EP-4168002-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS Revolution Medicines, Inc. (US) 2023-04-26 — — EP disclosed
WO-2021257736-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS Revolution Medicines, Inc. (US) 2021-12-23 — — WO disclosed
US-20210094975-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. 2021-04-01 — — 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-20210094975-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS MTOR, RICTOR, RPTOR JAK2 445/4885JAK3 2053/4885EGFR 852/4885

“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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