SCHEMBL6180565

SCHEMBL6180565

COc1cc2ncnc(N3CCC(c4ccccc4)CC3)c2cc1OC

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.76
ACHE P22303 5/20 0.70
BACE1 P56817 5/20 0.70
PDE10A Q9Y233 7/20 0.68
ENPP1 P22413 1/20 0.63
AURKA O14965 3/20 0.62
PDE3B Q13370 1/20 0.61
HTR1A P08908 1/20 0.60
HTR7 P34969 1/20 0.60

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
SCHEMBL5243398 0.86 PDE3A (1.00) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL5241625 0.82 PDE3A (0.68) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL5243694 0.82 PDE3A (0.68) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL5241619 0.82 PDE3A (0.68) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL5241633 0.82 PDE3A (0.68) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL5243679 0.82 PDE3A (0.68) PDE3AACHEBACE1PDE10APDE3B
SCHEMBL11882354 0.82 ACHE (0.88) ACHEBACE1PDE10AENPP1AURKA
SCHEMBL7276406 0.81 ENPP1 (0.73) PDE3AACHEBACE1PDE10AENPP1
SCHEMBL4965743 0.81 ENPP1 (0.70) PDE3AACHEBACE1PDE10AENPP1
SCHEMBL5245236 0.81 PDE10A (1.00) PDE3AACHEBACE1PDE10AAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871448-B1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE AVENTIS PHARMA INC (US) 2005-03-02 EP claimed
US-20040014774-A1 Aryl and heteroaryl quinazoline compounds which inhibit CSF-1R receptor tyrosine kinase AVENTIS PHARMACEUTICALS INC. 2004-01-22 US claimed
EP-0871448-A4 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE RHONE POULENC RORER PHARMA (US) 1999-12-29 EP claimed
EP-0871448-A1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-10-21 EP claimed
EP-0831831-A4 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE POULENC RORER PHARMA (US) 1998-05-27 EP claimed
EP-0831831-A1 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-04-01 EP claimed
US-5721237-A ADMINISTERING FOR THE SELECTIVE TREATMENT OF CELL GROWTH AND DIFFERENTIATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-02-24 US claimed
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US claimed
WO-1996039145-A1 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-12 WO claimed
WO-1995015758-A1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-06-15 WO claimed
EP-0871448-B1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE AVENTIS PHARMA INC (US) 2005-03-02 EP disclosed
EP-1488792-A2 Quinazoline compounds which inhibit CSF-1R receptor tyrosine kinase Aventis Pharmaceuticals Products Inc. (US) 2004-12-22 EP disclosed
US-20040014774-A1 Aryl and heteroaryl quinazoline compounds which inhibit CSF-1R receptor tyrosine kinase AVENTIS PHARMACEUTICALS INC. 2004-01-22 US disclosed
US-6645969-B1 Antiproliferative, anticarcinogenic, and antiinflammatory agents; treatment of leukemia, psoriasis, bone disorders, and atherosclerosis AVENTIS PHARMACEUTICALS INC. 2003-11-11 US disclosed
CN-1100540-C Protein tyrosine kinase aryl and heteroaryl quinazoline compounds having selective inhibition of HER-2 autophosphorylation properties AVENTIS PHARMA INC (US) 2003-02-05 CN disclosed
US-5710158-A INHIBITORS OF PROTEIN TYROSINE KINASE AND EPIDERMAL GROWTH FACTOR RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-01-20 US disclosed
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US disclosed
WO-1996039145-A1 PROTEIN TYROSINE KINASE ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS HAVING SELECTIVE INHIBITION OF HER-2 AUTOPHOSPHORYLATION PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-12 WO disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed
WO-1995015758-A1 ARYL AND HETEROARYL QUINAZOLINE COMPOUNDS WHICH INHIBIT CSF-1R RECEPTOR TYROSINE KINASE RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-06-15 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 (1 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-20040014774-A1 Aryl and heteroaryl quinazoline compounds which inhibit CSF-1R receptor tyrosine kinase CSF1R, CSF3R, FLT3 PDE3A 1443/4885ACHE 4476/4885BACE1 2913/4885

“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.