SCHEMBL3909682

SCHEMBL3909682

COc1ccc2nc(Nc3cccc(C)c3)cnc2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 0.76
PDGFRA P16234 6/20 0.76
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
POLB P06746 2/20 0.49
PIK3CA P42336 1/20 0.48
MAPK8 P45983 1/20 0.48
MAPK9 P45984 1/20 0.48
MAPK10 P53779 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 2/20 0.47
MAPK1 P28482 1/20 0.47
BRAF P15056 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
EGFR P00533 1/20 0.46
IGF1R P08069 1/20 0.46
ABCB1 P08183 1/20 0.45
ABCC1 P33527 1/20 0.45

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
SCHEMBL1401415 0.87 PDGFRB (1.00) PDGFRBPDGFRAMEN1KMT2APOLB
Hydrochloric Acid SCHEMBL3884102 0.85 PDGFRB (0.97) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL3426356 0.84 PDGFRB (0.71) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL3909734 0.81 PDGFRB (0.67) PDGFRBPDGFRABRAFEGFRROCK1
SCHEMBL3906854 0.75 PDGFRB (0.61) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL3915443 0.74 PDGFRB (0.76) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL4640696 0.74 PDGFRB (0.72) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL3916312 0.73 PDGFRB (0.74) PDGFRBPDGFRAMEN1KMT2APIK3CA
SCHEMBL15256286 0.72 PDGFRB (0.66) PDGFRBPDGFRAMEN1KMT2APOLB
SCHEMBL4544763 0.72 KCNH3 (0.67) MEN1KMT2APOLBPIK3CANPC1

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 18 patents. 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
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
US-20050182054-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. (US) 2005-08-18 US disclosed
US-6846815-B2 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. (US) 2005-01-25 US disclosed
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 disclosed
US-6524347-B1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVANTIS PHARMACEUTICALS INC. 2003-02-25 US disclosed
EP-1133479-A1 QUINOLINE AND QUINOXALINE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-09-19 EP disclosed
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 disclosed
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 disclosed
WO-2000031050-A1 QUINOLINE AND QUINOXALINE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-02 WO 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-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

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-20050182054-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases LCK, LTK, ABL1 PDGFRB 39/4885PDGFRA 45/4885MEN1 3202/4885
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.