SCHEMBL13845837

SCHEMBL13845837

Cc1cc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)ccc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 20/20 0.88
BCR P11274 14/20 0.88
KIT P10721 12/20 0.88
ABL2 P42684 7/20 0.88
PDGFRA P16234 3/20 0.88
LYN P07948 3/20 0.88
PDGFRB P09619 2/20 0.88
SRC P12931 2/20 0.88
SYK P43405 2/20 0.88
PLK4 O00444 1/20 0.88
DDX3X O00571 1/20 0.88
GAK O14976 1/20 0.88
SLC22A2 O15244 1/20 0.88
MAPK13 O15264 1/20 0.88
CA12 O43570 1/20 0.88
SLC22A3 O75751 1/20 0.88
ABCB11 O95342 1/20 0.88
EGFR P00533 1/20 0.88
CA1 P00915 1/20 0.88
CA2 P00918 1/20 0.88

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
SCHEMBL3867268 0.97 ABL1 (0.84) ABL1BCRKITABL2PDGFRA
SCHEMBL3863321 0.94 ABL1 (0.84) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL2236091 0.94 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL29355523 0.94 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL29351601 0.94 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL3827 0.94 ABL1 (1.00) ABL1BCRKITABL2PDGFRA
SCHEMBL12034589 0.94 ABL1 (0.78) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL529425 0.93 ABL1 (0.98) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL1977949 0.93 ABL1 (0.98) ABL1BCRKITABL2PDGFRA
Imatinib SCHEMBL16431247 0.93 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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111329863-A Use of a composition containing a heterocyclic compound for the preparation of a medicament for the treatment of leukemia 黄泳华 2020-06-26 CN claimed
CN-111298127-A Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same 黄泳华 2020-06-19 CN claimed
CN-110559299-A composition containing pyridyl pyrimidinamine compound and application thereof 黄泳华 2019-12-13 CN claimed
CN-110559443-A composition comprising histamine release-promoting substance and pyridylpyrimidine amine compound, and oral solid preparation containing the same 黄泳华 2019-12-13 CN claimed
US-20240240155-A1 Organoid-Derived Monolayers and Uses Thereof HUB ORGANOIDS IP B.V. (NL) 2024-07-18 US disclosed
US-20240240155-A1 Organoid-Derived Monolayers and Uses Thereof HUB ORGANOIDS IP B.V. (NL) 2024-07-18 US disclosed
US-20230272347-A1 Differentiation Method KONINKLIJKE NEDERLANDSE AKADEMIE VAN WETENSCHAPPEN (NL) 2023-08-31 US disclosed
US-20230272347-A1 Differentiation Method KONINKLIJKE NEDERLANDSE AKADEMIE VAN WETENSCHAPPEN (NL) 2023-08-31 US disclosed
US-11571475-B1 Anti-CD70 and BCR-ABL inhibitor combination therapy UNIVERSITY OF BERN (CH) 2023-02-07 US disclosed
US-20210047618-A1 Improved Differentiation Method KONINKLIJKE NEDERLANDSE AKADEMIE VAN WETENSCHAPPEN (NL) 2021-02-18 US disclosed
US-20210040454-A1 Improved Differentiation Method KONINKLIJKE NEDERLANDSE AKADEMIE VAN WETENSCHAPPEN (NL) 2021-02-11 US disclosed
CN-111329863-A Use of a composition containing a heterocyclic compound for the preparation of a medicament for the treatment of leukemia 黄泳华 2020-06-26 CN disclosed
CN-110559443-A composition comprising histamine release-promoting substance and pyridylpyrimidine amine compound, and oral solid preparation containing the same 黄泳华 2019-12-13 CN disclosed
US-10391168-B1 Anti-CD70 combination therapy UNIVERSITY OF BERN (CH) 2019-08-27 US disclosed
US-9907796-B2 Methods of treating tumoral diseases, or bacterial or viral infections INHIBIKASE THERAPEUTICS, INC. (US) 2018-03-06 US disclosed
US-20170000789-A1 Methods of Treating Tumoral Diseases, or Bacterial or Viral Infections SPHAERA PHARMA PTE. LTD. (SG) 2017-01-05 US disclosed
US-9487500-B2 Compounds and compositions thereof INHIBIKASE THERAPEUTICS, INC. (US) 2016-11-08 US disclosed
US-20130060030-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE NATCO PHARMA LIMITED (IN) 2013-03-07 US disclosed
US-20130060030-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE NATCO PHARMA LIMITED (IN) 2013-03-07 US disclosed
WO-2009060463-A1 AN ENVIRONMENTALLY FRIENDLY PROCESS FOR THE PREPARATION OF IMATINIB BASE NATCO PHARMA LIMITED (IN) 2009-05-14 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 (7 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-20230272347-A1 Differentiation Method MYADM, EPCAM, MCL1 ABL1 1958/4885BCR 2337/4885KIT 35/4885
US-10391168-B1 Anti-CD70 combination therapy ABL1, BCR, CD2BP2 ABL1 1/4885BCR 2/4885KIT 398/4885
US-20130060030-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE CRYSTALLINE IMATINIB BASE ABL1, ABL2, FGFR1 ABL1 1/4885BCR 51/4885KIT 11/4885
US-20210040454-A1 Improved Differentiation Method MYADM, EPCAM, KRT18 ABL1 2107/4885BCR 2827/4885KIT 39/4885
US-20170000789-A1 Methods of Treating Tumoral Diseases, or Bacterial or Viral Infections POLI, RNASE1, VHL ABL1 351/4885BCR 1670/4885KIT 4083/4885
US-20210047618-A1 Improved Differentiation Method VIPR2, IAPP, PROX1 ABL1 3358/4885BCR 4482/4885KIT 49/4885
US-11571475-B1 Anti-CD70 and BCR-ABL inhibitor combination therapy ABL1, BCR, ZAP70 ABL1 1/4885BCR 2/4885KIT 284/4885

“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.