SCHEMBL5652179

SCHEMBL5652179

COc1cc2ncnc(Oc3ccc(NC(=O)Nc4cc(C)ns4)cc3Cl)c2cc1OC

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.61
BRAF P15056 7/20 0.57
PDGFRA P16234 1/20 0.57
CSF1R P07333 2/20 0.55
RAF1 P04049 3/20 0.55
MET P08581 1/20 0.53
PDGFRB P09619 1/20 0.53
KIT P10721 1/20 0.53
SRC P12931 1/20 0.53
FLT1 P17948 1/20 0.53
FLT4 P35916 1/20 0.53

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
SCHEMBL5652729 0.88 KDR (0.75) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL5653372 0.84 KDR (0.67) KDRPDGFRAKITFLT1FLT4
SCHEMBL4671871 0.83 KDR (0.60) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL5655643 0.82 KDR (0.61) KDRBRAFPDGFRARAF1
SCHEMBL4669935 0.82 KDR (0.61) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL4668940 0.82 KDR (0.63) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL4668518 0.81 KDR (0.60) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL5652897 0.81 BRAF (0.75) KDRBRAFPDGFRACSF1RRAF1
SCHEMBL1780469 0.80 BRAF (0.84) KDRBRAFRAF1
SCHEMBL23158559 0.76 KDR (0.57) KDRBRAFPDGFRACSF1RPDGFRB

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-7211587-B2 Quinoline derivatives and quinazoline derivatives having azolyl group KIRIN BEER KABUSHIKI KAISHA (KR) 2007-05-01 US claimed
EP-1652847-A1 Quinoline and quinazoline derivatives for the treatment of tumors KIRIN BEER KABUSHIKI KAISHA (JP) 2006-05-03 EP claimed
US-7211587-B2 Quinoline derivatives and quinazoline derivatives having azolyl group KIRIN BEER KABUSHIKI KAISHA (KR) 2007-05-01 US disclosed
EP-1652847-A1 Quinoline and quinazoline derivatives for the treatment of tumors KIRIN BEER KABUSHIKI KAISHA (JP) 2006-05-03 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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20040229876-A1 Quinoline derivatives and quinazoline derivatives having azolyl group NQO2, H1-5, NRAS KDR 3455/4885BRAF 402/4885PDGFRA 4104/4885
US-20030087907-A1 Quinoline derivatives and quinazoline derivatives having azolyl group NQO2, H1-5, NRAS KDR 3455/4885BRAF 402/4885PDGFRA 4104/4885

“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.