SCHEMBL7702572

SCHEMBL7702572

Cc1cccc(NC(=O)Nc2ccc(-c3nn(C4CCN(C(=O)CN(C)C(=O)O)CC4)c4ncnc(N)c34)cc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 7/20 0.52
▸ KDR P35968 5/20 0.52
▸ SRC P12931 5/20 0.52
▸ TEK Q02763 2/20 0.52
▸ KIT P10721 2/20 0.49
▸ FLT3 P36888 2/20 0.49
▸ AURKA O14965 1/20 0.49
▸ IKBKE Q14164 1/20 0.49
▸ AURKB Q96GD4 1/20 0.49
▸ BTK Q06187 3/20 0.48
▸ EGFR P00533 4/20 0.47
▸ ITK Q08881 3/20 0.46
▸ PDGFRB P09619 2/20 0.45
▸ HDAC1 Q13547 2/20 0.45
▸ LIMK1 P53667 1/20 0.44
▸ LIMK2 P53671 1/20 0.44

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
SCHEMBL6430834 0.95 LCK (0.53) LCKKDRSRCTEKKIT
SCHEMBL6433914 0.91 LCK (0.49) LCKKDRSRCTEKKIT
SCHEMBL6431567 0.90 LCK (0.57) LCKKDRSRCTEKKIT
SCHEMBL6431538 0.90 LCK (0.53) LCKKDRSRCTEKKIT
Acetic Acid SCHEMBL6434178 0.88 LCK (0.50) LCKKDRSRCTEKKIT
SCHEMBL7702573 0.87 LCK (0.52) LCKKDRSRCTEKKIT
SCHEMBL7004695 0.87 LCK (0.50) LCKKDRSRCTEKKIT
Acetic Acid SCHEMBL6430313 0.86 LCK (0.50) LCKKDRSRCTEKKIT
SCHEMBL5802530 0.85 LCK (0.54) LCKKDRSRCTEKKIT
SCHEMBL6430319 0.84 LCK (0.49) LCKKDRSRCTEKKIT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020156081-A1 Pyrazolopyrimidines as therapeutic agents ABBOTT LABORATORIES (US) 2002-10-24 — — 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-20020156081-A1 Pyrazolopyrimidines as therapeutic agents DPYD, CYP2D6, UGT1A1 LCK 1011/4885KDR 1166/4885SRC 1834/4885

“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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