SCHEMBL4669897

SCHEMBL4669897

COc1cc2ncnc(Oc3ccc(N)cc3Cl)c2cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.59
EGFR P00533 6/20 0.58
LCK P06239 2/20 0.58
TRPA1 O75762 1/20 0.57
RET P07949 2/20 0.52
KIT P10721 2/20 0.52
KIF5B P33176 1/20 0.52
SRC P12931 2/20 0.50
RIPK2 O43353 1/20 0.50
NOD1 Q9Y239 1/20 0.50
FLT4 P35916 3/20 0.48
FLT1 P17948 2/20 0.48
PDGFRA P16234 2/20 0.48
CLK1 P49759 2/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
PDGFRB P09619 2/20 0.46
CSF1R P07333 1/20 0.46
FLT3 P36888 1/20 0.46
AURKA O14965 1/20 0.46
ERBB2 P04626 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
SCHEMBL5205269 0.85 TRPA1 (0.59) KDREGFRLCKTRPA1RET
SCHEMBL5824789 0.84 TRPA1 (0.76) KDREGFRLCKTRPA1RET
SCHEMBL2481753 0.82 LCK (0.66) KDREGFRLCKTRPA1RET
SCHEMBL23158559 0.82 KDR (0.57) KDREGFRLCKTRPA1RET
SCHEMBL1013499 0.82 TRPA1 (0.64) KDREGFRLCKTRPA1RET
SCHEMBL168497 0.82 PDGFRA (0.59) KDREGFRSRCPDGFRAPDGFRB
SCHEMBL16933076 0.81 KDR (0.62) KDREGFRLCKTRPA1RET
SCHEMBL31616965 0.80 KDR (0.74) KDREGFRLCKTRPA1RET
SCHEMBL4668514 0.80 KDR (0.74) KDREGFRLCKTRPA1RET
SCHEMBL1012099 0.80 KDR (0.70) KDREGFRLCKTRPA1RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1652847-B1 Quinoline and quinazoline derivatives for the treatment of tumors KIRIN PHARMA KK (JP) 2008-05-28 EP disclosed
US-7211587-B2 Quinoline derivatives and quinazoline derivatives having azolyl group KIRIN BEER KABUSHIKI KAISHA (KR) 2007-05-01 US disclosed
US-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US disclosed
US-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-21 US disclosed
EP-1652847-A1 Quinoline and quinazoline derivatives for the treatment of tumors KIRIN BEER KABUSHIKI KAISHA (JP) 2006-05-03 EP disclosed
EP-1382604-B1 QUINOLINE DERIVATIVE HAVING AZOLYL GROUP AND QUINAZOLINE DERIVATIVE KIRIN BREWERY (JP) 2005-12-28 EP disclosed
US-6821987-B2 4-SUBSTITUTED BY AZOLYLUREIDO-PHENOXY, OR PHENYLTHIO; ANTITUMOR AGENTS; TREATING DIABETIC RETINOPATHY, CHRONIC RHEUMATISM, PSORIASIS, ATHEROSCLEROSIS, KIRIN BEER KABUSHIKI KAISHA (JP) 2004-11-23 US disclosed
US-20040229876-A1 Quinoline derivatives and quinazoline derivatives having azolyl group KIRIN BEER KABUSHIKI KAISHA (JP) 2004-11-18 US disclosed
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2004-07-08 US disclosed
EP-1382604-A1 QUINOLINE DERIVATIVE HAVING AZOLYL GROUP AND QUINAZOLINE DERIVATIVE KIRIN BEER KABUSHIKI KAISHA (JP) 2004-01-21 EP disclosed
US-20030087907-A1 Quinoline derivatives and quinazoline derivatives having azolyl group KIRIN BEER KABUSHIKI KAISHA (JP) 2003-05-08 US disclosed
EP-1243582-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND DRUGS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2002-09-25 EP 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-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA KDR 4/4885EGFR 24/4885LCK 253/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA KDR 5/4885EGFR 20/4885LCK 210/4885
US-20040229876-A1 Quinoline derivatives and quinazoline derivatives having azolyl group NQO2, H1-5, NRAS KDR 3455/4885EGFR 2691/4885LCK 2024/4885
US-20030087907-A1 Quinoline derivatives and quinazoline derivatives having azolyl group NQO2, H1-5, NRAS KDR 3455/4885EGFR 2691/4885LCK 2024/4885

“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.