SCHEMBL2050160

SCHEMBL2050160

O=C(Cn1cc(Nc2ncnc3cc(OCCCCl)ccc23)cn1)Nc1cccc(F)c1F

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.57
CSF1R P07333 2/20 0.57
KIT P10721 1/20 0.57
PDGFRA P16234 1/20 0.57
CYP3A4 P08684 1/20 0.54
FLT4 P35916 4/20 0.53
FLT3 P36888 3/20 0.53
AURKA O14965 8/20 0.50
AURKB Q96GD4 2/20 0.50
EGFR P00533 4/20 0.45
KDR P35968 4/20 0.45
BRAF P15056 3/20 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
Hydrochloric Acid SCHEMBL3427279 0.99 PDGFRB (0.56) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL2053159 0.97 PDGFRB (0.57) PDGFRBCSF1RKITPDGFRACYP3A4
Hydrochloric Acid SCHEMBL3427687 0.96 PDGFRB (0.56) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL2031479 0.94 PDGFRB (0.59) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL2049575 0.94 PDGFRB (0.57) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL3431829 0.94 PDGFRB (0.52) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL3427507 0.91 FLT4 (0.55) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL2053244 0.90 PDGFRB (0.56) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL2049362 0.90 PDGFRB (0.56) PDGFRBCSF1RKITPDGFRACYP3A4
SCHEMBL3431150 0.90 PDGFRB (0.56) PDGFRBCSF1RKITPDGFRACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4709139-B2 2011-06-22 JP claimed
US-7691867-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-04-06 US claimed
EP-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP claimed
US-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 US claimed
JP-2006523660-A 2006-10-19 JP claimed
EP-1613619-A1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER AstraZeneca AB (SE) 2006-01-11 EP claimed
WO-2004094410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-11-04 WO claimed
US-7691867-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-04-06 US disclosed
US-20080269500-A1 Process for the Preparation of 4-Aminopyrazole Derivatives ASTRAZENECA AB (SE) 2008-10-30 US disclosed
EP-1931639-A2 PROCESS Astra Zeneca AB (SE) 2008-06-18 EP disclosed
EP-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP disclosed
WO-2007034183-A2 PROCESS FOR THE PREPARATION OF 4-AMINOPYRAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2007-03-29 WO disclosed
US-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 US disclosed
EP-1613619-A1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER AstraZeneca AB (SE) 2006-01-11 EP disclosed
WO-2004094410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-11-04 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-20060270692-A1 Chemical compounds CCNI, MKI67, TP53 PDGFRB 1544/4885CSF1R 3570/4885KIT 50/4885
US-20080269500-A1 Process for the Preparation of 4-Aminopyrazole Derivatives CYP3A4, CYP3A43, CYP3A5 PDGFRB 1636/4885CSF1R 3151/4885KIT 278/4885

“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.