SCHEMBL22086027

SCHEMBL22086027

Clc1ncnc2c1c(-c1ccccc1)cn2-c1cccnc1

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 8/20 0.80
▸ EGFR P00533 6/20 0.56
▸ ABL1 P00519 5/20 0.56
▸ ABL2 P42684 5/20 0.56
▸ KDR P35968 4/20 0.56
▸ CDK1 P06493 3/20 0.56
▸ TP53 P04637 2/20 0.51
▸ LMNA P02545 5/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ PDE11A Q9HCR9 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.45

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
SCHEMBL30150810 1.00 SRC (0.80) SRCEGFRABL1ABL2KDR
SCHEMBL30150807 1.00 SRC (0.80) SRCEGFRABL1ABL2KDR
SCHEMBL22086067 0.94 SRC (0.78) SRCEGFRABL1ABL2KDR
SCHEMBL22604442 0.89 SRC (1.00) SRCEGFRABL1ABL2KDR
SCHEMBL22086070 0.87 SRC (0.84) SRCEGFRABL1ABL2KDR
SCHEMBL22084743 0.87 SRC (0.84) SRCEGFRABL1ABL2KDR
SCHEMBL22084757 0.82 SRC (0.55) SRCEGFRABL1ABL2KDR
SCHEMBL20911785 0.82 SRC (0.84) SRCEGFRABL1ABL2KDR
SCHEMBL20351621 0.81 SRC (0.82) SRCEGFRABL1ABL2KDR
SCHEMBL22084756 0.80 SRC (0.52) SRCEGFRABL1ABL2KDR

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-20230055250-A1 MAP4K4 INHIBITORS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-02-23 — — US disclosed
WO-2020115481-A1 MAP4K4 INHIBITORS IMPERIAL COLLEGE OF SCIENCE, TECHNOLOGY AND MEDICINE (GB) 2020-06-11 — — 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-20230055250-A1 MAP4K4 INHIBITORS MAP4K4, MAP4K5, MAP4K1 SRC 739/4885EGFR 1053/4885ABL1 147/4885

“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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