SCHEMBL1401415

SCHEMBL1401415

COc1ccc2nc(Nc3ccccc3)cnc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 1.00
PDGFRA P16234 6/20 1.00
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
RAB9A P51151 6/20 0.55
NPC1 O15118 5/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 2/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 2/20 0.53
ALDH1A1 P00352 1/20 0.53
NQO2 P16083 1/20 0.53
EGFR P00533 3/20 0.52
MAPT P10636 2/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
BRAF P15056 1/20 0.50
IGF1R P08069 1/20 0.47
GAA P10253 1/20 0.47

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
Hydrochloric Acid SCHEMBL3884102 0.99 PDGFRB (0.97) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL3909682 0.87 PDGFRB (0.76) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL3915443 0.86 PDGFRB (0.76) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL3916312 0.85 PDGFRB (0.74) PDGFRBPDGFRAMEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL1401417 0.84 PDGFRB (0.72) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL4640696 0.84 PDGFRB (0.72) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL3426356 0.83 PDGFRB (0.71) PDGFRBPDGFRAMEN1KMT2ARAB9A
SCHEMBL3909786 0.82 PDGFRB (1.00) PDGFRBPDGFRASMN1; SMN2ALDH1A1NQO2
SCHEMBL3909734 0.81 PDGFRB (0.67) PDGFRBPDGFRAEGFRBRAF
SCHEMBL7696400 0.80 PDGFRB (0.76) PDGFRBPDGFRAMEN1KMT2ARAB9A

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030144284-A1 Heterocyclic imines such as 2-anilino-6-quinoxalinol, used to suppress cell proliferation, differentiation, chemotaxis and/or activation; prophylaxis of restinosis; anticarcinogenic agents AVENTIS PHARMACEUTICALS INC. 2003-07-31 US claimed
EP-1133479-A1 QUINOLINE AND QUINOXALINE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-09-19 EP claimed
US-6159978-A Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS PRODUCT, INC. (US) 2000-12-12 US claimed
EP-0991628-A4 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR P56?lck TYROSINE KINASES RHONE POULENC RORER PHARMA (US) 2000-07-26 EP claimed
WO-2000031050-A1 QUINOLINE AND QUINOXALINE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-02 WO claimed
EP-0991628-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR P56?lck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-04-12 EP claimed
WO-1998054156-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR P56lck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-12-03 WO claimed
EP-1001945-B1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56lck TYROSINE KINASES AVENTIS PHARMA INC (US) 2011-03-02 EP disclosed
EP-1001946-B1 QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56lck TYROSINE KINASES AVENTIS PHARMA INC (US) 2010-12-29 EP disclosed
US-7550597-B2 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS, INC. (US) 2009-06-23 US disclosed
EP-1687642-B1 Screening methods for combinations of biological compounds CENTELION (FR) 2009-01-14 EP disclosed
US-20070197538-A1 Anti-vascular and anti-proliferation methods, therapies, and combinations employing specific tyrosine kinase inhibitors AVENTIS PHARMA S.A. (FR) 2007-08-23 US disclosed
EP-1687642-A2 ANTI-VASCULAR AND ANTI-PROLIFERATION METHODS, THERAPIES, AND COMBINATIONS EMPLOYING SPECIFIC TYROSINE KINASE INHIBITORS CENTELION (FR) 2006-08-09 EP disclosed
WO-2000031051-A1 QUINOLINE AND QUINOXALINE COMPOUNDS AS PDGF-RECEPTOR AND/OR LCK TYROSINE KINASE INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-02 WO disclosed
EP-1001946-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56?1ck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-05-24 EP disclosed
EP-1001945-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56?lck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-05-24 EP disclosed
EP-0991628-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR P56?lck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-04-12 EP disclosed
WO-1998054158-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56lck TYROSINE KINASES RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-12-03 WO disclosed
WO-1998054156-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR P56lck TYROSINE KINASES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-12-03 WO disclosed
WO-1998054157-A1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p561ck TYROSINE KINASES RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-12-03 WO 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-20070197538-A1 Anti-vascular and anti-proliferation methods, therapies, and combinations employing specific tyrosine kinase inhibitors MCL1, ABL1, TIE1 PDGFRB 13/4885PDGFRA 10/4885MEN1 508/4885
US-20030144284-A1 Heterocyclic imines such as 2-anilino-6-quinoxalinol, used to suppress cell proliferation, differentiation, chemotaxis and/or activation; prophylaxis of restinosis; anticarcinogenic agents LCK, NFATC1, MAP2K2 PDGFRB 106/4885PDGFRA 299/4885MEN1 2313/4885

“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.