SCHEMBL2448819

SCHEMBL2448819

Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1N(c1cccnc1)c1ncccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 14/20 0.61
BCR P11274 13/20 0.61
KIT P10721 8/20 0.61
PDGFRA P16234 4/20 0.61
EGFR P00533 3/20 0.61
LCK P06239 3/20 0.61
CSF1R P07333 3/20 0.61
PDGFRB P09619 3/20 0.61
SRC P12931 3/20 0.61
ERBB2 P04626 2/20 0.61
FYN P06241 2/20 0.61
LYN P07948 2/20 0.61
FGR P09769 2/20 0.61
BRAF P15056 2/20 0.61
NQO2 P16083 2/20 0.61
EPHA8 P29322 2/20 0.61
ABL2 P42684 2/20 0.61
FRK P42685 2/20 0.61
BLK P51451 2/20 0.61
DDR1 Q08345 2/20 0.61

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
SCHEMBL5990469 0.90 HIF1A (0.57) ABL1BCRKITPDGFRAEGFR
SCHEMBL2930443 0.86 ABL1 (0.56) ABL1BCRKITPDGFRACSF1R
SCHEMBL8191704 0.83 ABL1 (0.72) ABL1BCRKITPDGFRAEGFR
SCHEMBL23258781 0.83 ABL1 (0.71) ABL1BCRKITPDGFRAEGFR
SCHEMBL715917 0.82 LCK (0.56) ABL1BCRKITPDGFRAEGFR
SCHEMBL10075315 0.82 ABL1 (0.70) ABL1BCRKITPDGFRAEGFR
SCHEMBL2317952 0.82 ABL1 (0.70) ABL1BCRKITPDGFRAEGFR
SCHEMBL10109122 0.81 ABL1 (0.72) ABL1BCRKITPDGFRAEGFR
SCHEMBL29198404 0.81 ABL1 (0.74) ABL1BCRKITPDGFRAEGFR
SCHEMBL5004999 0.80 ABL1 (0.60) ABL1BCRKITPDGFRAEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720853-B2 PHARMACEUTICAL COMPOSITIONS OF THE 2 CRYSTALLINE FORM OF IMATINIB MESYLATE FOR USE IN THE TREATMENT OF CHRONIC MYELOGENOUS LEUKEMIA NATCO PHARMA LTD (IN) 2023-06-28 EP disclosed
WO-2013035102-A1 PROCESSES FOR THE PREPARATION OF IMATINIB BASE AND INTERMEDIATES THEREOF NATCO PHARMA LIMITED (IN) 2013-03-14 WO disclosed
US-20130060030-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE NATCO PHARMA LIMITED (IN) 2013-03-07 US disclosed
EP-2547671-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE Natco Pharma Limited (IN) 2013-01-23 EP disclosed
US-8048883-B2 Chronic Myelogenous Leukemia; crystal form stable at room temperature or higher temperatures up to 120 degrees C. and accelerated stress conditions, freely soluble in water; suspending Imatinib base in isopropanol and adding methane sulfonic acid at room temperature then cooling after reactoion NATCO PHARMA LIMITED (IN) 2011-11-01 US disclosed
WO-2011114337-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE NATCO PHARMA LIMITED (IN) 2011-09-22 WO disclosed
WO-2009060463-A1 AN ENVIRONMENTALLY FRIENDLY PROCESS FOR THE PREPARATION OF IMATINIB BASE NATCO PHARMA LIMITED (IN) 2009-05-14 WO disclosed
WO-2008136010-A1 A PROCESS FOR THE PREPARATION OF HIGHLY PURE IMATINIB BASE NATCO PHARMA LIMITED (IN) 2008-11-13 WO disclosed
US-20080255138-A1 Novel Polymorphic Form Of Imatinib Mesylate And A Process For Its Preparation NATCO PHARMA LIMITED (IN) 2008-10-16 US disclosed
EP-1742933-A2 CRYSTALLINE METHANESULFONIC ACID ADDITION SALTS OF IMATINIB INSTYTUT FARMACEUTYCZNY (PL) 2007-01-17 EP disclosed
US-20060111363-A1 Treatment of uveal melanoma ALL-ERICSSON CHARLOTTA 2006-05-25 US disclosed
WO-2005095379-A2 CRYSTALLINE METHANESULFONIC ACID ADDITION SALTS OF IMATINIB INSTYTUT FARMACEUTYCZNY (PL) 2005-10-13 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 (3 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-20060111363-A1 Treatment of uveal melanoma MITF, ALDH1A2, UACA ABL1 2500/4885BCR 4868/4885KIT 1141/4885
US-20080255138-A1 Novel Polymorphic Form Of Imatinib Mesylate And A Process For Its Preparation ABL1, ABL2, BCR ABL1 1/4885BCR 3/4885KIT 24/4885
US-20130060030-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE ABL1, ABL2, FGFR1 ABL1 1/4885BCR 51/4885KIT 11/4885

“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.