SCHEMBL22505591

SCHEMBL22505591

COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(C(C)(C)C)n[nH]4)c(Cl)c3Cl)c2cc1C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 12/20 0.53
▸ PDGFRB P09619 4/20 0.53
▸ KDR P35968 14/20 0.52
▸ KIT P10721 4/20 0.52
▸ RET P07949 3/20 0.52
▸ FGFR1 P11362 3/20 0.52
▸ FLT1 P17948 3/20 0.52
▸ FLT4 P35916 3/20 0.52
▸ AURKB Q96GD4 3/20 0.52
▸ MAPK14 Q16539 2/20 0.52
▸ RIPK2 O43353 2/20 0.52
▸ STK10 O94804 2/20 0.52
▸ ABL1 P00519 2/20 0.52
▸ BCR P11274 2/20 0.52
▸ FGFR2 P21802 2/20 0.52
▸ SLC6A3 Q01959 2/20 0.52
▸ DDR1 Q08345 2/20 0.52
▸ MAP4K2 Q12851 2/20 0.52
▸ PTK6 Q13882 2/20 0.52
▸ DDR2 Q16832 2/20 0.52

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
SCHEMBL22505653 0.94 PDGFRA (0.52) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505564 0.92 PDGFRA (0.44) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505589 0.91 PDGFRA (0.43) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505607 0.91 KDR (0.50) PDGFRAPDGFRBKDRKITRET
SCHEMBL22535138 0.89 KDR (0.43) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505603 0.88 KDR (0.68) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505735 0.88 PDGFRA (0.54) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505585 0.87 KDR (0.57) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505568 0.86 PDGFRA (0.48) PDGFRAPDGFRBKDRKITRET
SCHEMBL22505724 0.85 BRAF (0.53) PDGFRAPDGFRBKDRKITRET

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-10800741-B2 Quinoline compound, preparation method and medical use therefor ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2020-10-13 — — US disclosed
US-10800741-B2 Quinoline compound, preparation method and medical use therefor ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2020-10-13 — — 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-10800741-B2 Quinoline compound, preparation method and medical use therefor WEE2, WEE1, HASPIN PDGFRA 2993/4885PDGFRB 3094/4885KDR 2448/4885

“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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