SCHEMBL22505737

SCHEMBL22505737

COc1cc2nccc(Nc3ccc(NC(=O)O)c(Cl)c3)c2cc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 11/20 0.54
▸ PDGFRA P16234 4/20 0.54
▸ RET P07949 3/20 0.54
▸ FLT1 P17948 3/20 0.54
▸ FLT4 P35916 3/20 0.54
▸ PDGFRB P09619 2/20 0.54
▸ KIT P10721 2/20 0.54
▸ FGFR1 P11362 2/20 0.54
▸ RIPK2 O43353 1/20 0.54
▸ ERN1 O75460 1/20 0.54
▸ STK10 O94804 1/20 0.54
▸ MAP3K6 O95382 1/20 0.54
▸ ABL1 P00519 1/20 0.54
▸ ESR1 P03372 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54
▸ BCR P11274 1/20 0.54
▸ NQO2 P16083 1/20 0.54
▸ TBXA2R P21731 1/20 0.54
▸ FGFR2 P21802 1/20 0.54
▸ FGFR4 P22455 1/20 0.54

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
SCHEMBL22535121 0.89 PDGFRA (0.51) KDRPDGFRARETFLT1FLT4
SCHEMBL22535136 0.88 KDR (0.52) KDRPDGFRARETFLT1FLT4
SCHEMBL22505593 0.87 EGFR (0.57) KDRPDGFRARETFLT1FLT4
SCHEMBL2177590 0.83 KDR (0.76) KDRPDGFRARETFLT1FLT4
SCHEMBL22505664 0.83 KDR (0.49) KDRPDGFRARETFLT1FLT4
SCHEMBL22505626 0.83 BRAF (0.53) KDRPDGFRARETFLT1FLT4
SCHEMBL28431630 0.82 SRC (0.59) KDRPDGFRARETFLT1FLT4
SCHEMBL28968030 0.79 EGFR (0.57) KDRPDGFRARIPK2STK10ABL1
SCHEMBL30115310 0.79 EGFR (0.57) KDRPDGFRARIPK2STK10ABL1
SCHEMBL28434572 0.79 KDR (0.71) KDRPDGFRARETFLT1FLT4

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-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 KDR 2448/4885PDGFRA 2993/4885RET 1448/4885

“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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