SCHEMBL7702164

SCHEMBL7702164

Cc1cccc(NC(=O)Nc2ccc(-c3nn(CC(=O)N4CCN(C)CC4)c4ncnc(N)c34)cc2F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.56
▸ AURKB Q96GD4 2/20 0.56
▸ IKBKE Q14164 1/20 0.56
▸ KDR P35968 13/20 0.55
▸ PDGFRB P09619 4/20 0.55
▸ HDAC1 Q13547 4/20 0.55
▸ FLT3 P36888 5/20 0.54
▸ KIT P10721 4/20 0.54
▸ TEK Q02763 3/20 0.48
▸ SRC P12931 3/20 0.48
▸ LCK P06239 3/20 0.48
▸ RIPK1 Q13546 3/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ FGFR1 P11362 3/20 0.46
▸ RET P07949 2/20 0.46
▸ SYK P43405 2/20 0.46
▸ BLK P51451 2/20 0.46
▸ MAP4K5 Q9Y4K4 2/20 0.46
▸ PDPK1 O15530 1/20 0.46
▸ DAPK3 O43293 1/20 0.46

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
SCHEMBL5801783 0.92 AURKB (0.53) AURKAAURKBIKBKEKDRPDGFRB
SCHEMBL5801797 0.85 AURKA (0.57) AURKAAURKBIKBKEKDRPDGFRB
SCHEMBL6437239 0.84 KDR (0.66) AURKAAURKBIKBKEKDRPDGFRB
SCHEMBL6430399 0.82 LCK (0.72) AURKAAURKBIKBKEKDRTEK
SCHEMBL6430396 0.82 LCK (0.72) AURKAAURKBIKBKEKDRTEK
SCHEMBL5803692 0.81 KDR (0.62) AURKAAURKBIKBKEKDRPDGFRB
Acetic Acid SCHEMBL6435211 0.81 LCK (0.71) AURKAAURKBIKBKEKDRTEK
Acetic Acid SCHEMBL6435206 0.81 LCK (0.71) AURKAAURKBIKBKEKDRTEK
SCHEMBL6430834 0.81 LCK (0.53) AURKAAURKBIKBKEKDRPDGFRB
SCHEMBL6431538 0.81 LCK (0.53) AURKAAURKBIKBKEKDRPDGFRB

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 AURKA 443/4885AURKB 481/4885IKBKE 2508/4885

“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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