SCHEMBL2177590

SCHEMBL2177590

COc1cc2nccc(Oc3ccc(NC(=O)O)c(Cl)c3)c2cc1C(N)=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.76
PDGFRA P16234 6/20 0.76
AURKB Q96GD4 6/20 0.76
RET P07949 5/20 0.76
FLT1 P17948 4/20 0.76
FLT4 P35916 4/20 0.76
PDGFRB P09619 4/20 0.76
KIT P10721 3/20 0.76
FGFR1 P11362 3/20 0.76
ABL1 P00519 3/20 0.76
RIPK2 O43353 2/20 0.76
STK10 O94804 2/20 0.76
BCR P11274 2/20 0.76
SLC6A3 Q01959 2/20 0.76
DDR1 Q08345 2/20 0.76
MAP4K2 Q12851 2/20 0.76
PTK6 Q13882 2/20 0.76
DDR2 Q16832 2/20 0.76
RIPK3 Q9Y572 2/20 0.76
ERN1 O75460 1/20 0.76

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
SCHEMBL1890089 0.93 KDR (0.77) KDRPDGFRAAURKBRETFLT1
SCHEMBL23366513 0.93 KDR (0.83) KDRPDGFRAAURKBRETFLT1
SCHEMBL19072630 0.92 KDR (0.76) KDRPDGFRAAURKBRETFLT1
SCHEMBL19957067 0.91 KDR (0.75) KDRPDGFRAAURKBRETFLT1
SCHEMBL19957141 0.91 KDR (0.75) KDRPDGFRAAURKBRETFLT1
SCHEMBL3503400 0.91 KDR (0.64) KDRPDGFRAAURKBRETFLT1
SCHEMBL22505669 0.91 KDR (0.64) KDRPDGFRAAURKBRETFLT1
SCHEMBL863668 0.91 KDR (0.79) KDRPDGFRAAURKBRETFLT1
SCHEMBL26726698 0.90 KDR (0.73) KDRPDGFRAAURKBRETFLT1
SCHEMBL23544752 0.90 KDR (0.73) KDRPDGFRAAURKBRETFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236050-B2 Polymorphs of 4-[3-chloro-4-(n′-cyclopropyl ureido)phenoxy] -7-methoxyquinoline-6-carboxamide, its salts and process for the preparation thereof MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2022-02-01 US disclosed
CN-113372270-A Lunvatinib and preparation method thereof 江西国药有限责任公司 2021-09-10 CN disclosed
US-20210188778-A1 NOVEL POLYMORPHS OF 4-[3-CHLORO-4-(N'-CYCLOPROPYL UREIDO)PHENOXY]-7-METHOXYQUINOLINE-6-CARBOXAMIDE, ITS SALTS AND PROCESS FOR THE PREPARATION THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2021-06-24 US disclosed
CN-110283122-B Preparation method of high-purity Lunvatinib and salt thereof 石药集团中奇制药技术(石家庄)有限公司 2021-05-25 CN disclosed
US-10800741-B2 Quinoline compound, preparation method and medical use therefor ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2020-10-13 US disclosed
WO-2019111283-A1 NOVEL POLYMORPHS OF 4-[3-CHLORO-4-(N'-CYCLOPROPYL UREIDO)PHENOXY]-7-METHOXYQUINOLINE-6-CARBOXAMIDE, ITS SALTS AND PROCESS FOR THE PREPARATION THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2019-06-13 WO disclosed
US-7973160-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-07-05 US disclosed
US-20100197911-A1 Nitrogen-Containing Aromatic Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-05 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 (4 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-20100197911-A1 Nitrogen-Containing Aromatic Derivatives GNG2, GCG, FRG1 KDR 2687/4885PDGFRA 3131/4885AURKB 1909/4885
US-11236050-B2 Polymorphs of 4-[3-chloro-4-(n′-cyclopropyl ureido)phenoxy] -7-methoxyquinoline-6-carboxamide, its salts and process for the preparation thereof UGT1A1, CYP4B1, CYP1B1 KDR 4267/4885PDGFRA 1620/4885AURKB 3656/4885
US-20210188778-A1 NOVEL POLYMORPHS OF 4-[3-CHLORO-4-(N'-CYCLOPROPYL UREIDO)PHENOXY]-7-METHOXYQUINOLINE-6-CARBOXAMIDE, ITS SALTS AND PROCESS FOR THE PREPARATION THEREOF CYP4B1, UGT1A1, CYP3A4 KDR 4133/4885PDGFRA 1316/4885AURKB 3755/4885
US-10800741-B2 Quinoline compound, preparation method and medical use therefor WEE2, WEE1, HASPIN KDR 2448/4885PDGFRA 2993/4885AURKB 406/4885

“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.