SCHEMBL22086034

SCHEMBL22086034

COCCOc1ccc(-c2cn(-c3ccncc3)c3ncnc(Cl)c23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 6/20 0.54
▸ CA12 O43570 3/20 0.47
▸ CA1 P00915 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ CA9 Q16790 3/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ EGFR P00533 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ ABL2 P42684 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.46
▸ LMNA P02545 4/20 0.43
▸ TP53 P04637 3/20 0.43
▸ MAPT P10636 3/20 0.42
▸ POLB P06746 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL22086061 0.87 SRC (0.48) SRCCA12CA1CA2CA9
SCHEMBL22086534 0.81 LMNA (0.50) SRCCA12CA1CA2CA9
SCHEMBL22086063 0.80 LMNA (0.48) SRCCA12CA1CA2CA9
SCHEMBL22086435 0.79 MAPT (0.63) SRCCA12CA1CA2CA9
SCHEMBL22084743 0.79 SRC (0.84) SRCCA12CA1CA2CA9
SCHEMBL20912366 0.78 SRC (0.70) SRCCA12CA1CA2CA9
SCHEMBL20912251 0.78 SRC (0.65) SRCCA12CA1CA2CA9
SCHEMBL20911841 0.78 SRC (0.73) SRCCA12CA1CA2CA9
SCHEMBL20912242 0.78 SRC (0.76) SRCABL1EGFRKDRABL2
SCHEMBL22086070 0.77 SRC (0.84) SRCCA12CA1CA2CA9

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 739/4885CA12 4722/4885CA1 4437/4885

“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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