SCHEMBL3857816

SCHEMBL3857816

Cc1ccc(NC(=O)c2ccc(CN3CCCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 20/20 0.94
BCR P11274 14/20 0.94
KIT P10721 12/20 0.94
ABL2 P42684 7/20 0.94
PDGFRA P16234 3/20 0.94
LYN P07948 3/20 0.94
PDGFRB P09619 2/20 0.94
SRC P12931 2/20 0.94
SYK P43405 2/20 0.94
PLK4 O00444 1/20 0.94
DDX3X O00571 1/20 0.94
GAK O14976 1/20 0.94
SLC22A2 O15244 1/20 0.94
MAPK13 O15264 1/20 0.94
CA12 O43570 1/20 0.94
SLC22A3 O75751 1/20 0.94
ABCB11 O95342 1/20 0.94
EGFR P00533 1/20 0.94
CA1 P00915 1/20 0.94
CA2 P00918 1/20 0.94

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
Acetic Acid SCHEMBL3863232 0.98 ABL1 (0.90) ABL1BCRKITABL2PDGFRA
SCHEMBL3859559 0.97 ABL1 (0.94) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL3827 0.97 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL29355523 0.97 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL2236091 0.97 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL29351601 0.97 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL1462774 0.96 ABL1 (0.98) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL1977949 0.96 ABL1 (0.98) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL16431247 0.96 ABL1 (0.98) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL15201213 0.96 ABL1 (0.98) ABL1BCRKITABL2PDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595323-B2 N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL YANG PHARM. CO., LTD. (KR) 2009-09-29 US disclosed
US-20040248918-A1 Anticancer agents IL YANG PHARM. CO., LTD. 2004-12-09 US disclosed
WO-2004099186-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL YANG PHARM CO., LTD. (KR) 2004-11-18 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-20040248918-A1 Anticancer agents BRDT, CHIA, RNASE1 ABL1 1106/4885BCR 2730/4885KIT 851/4885

“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.