SCHEMBL21392511

SCHEMBL21392511

Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCC(CCO)CC2)n1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 6/20 0.89
ABL1 P00519 10/20 0.78
SRC P12931 8/20 0.78
EGFR P00533 3/20 0.78
FYN P06241 3/20 0.78
YES1 P07947 3/20 0.78
LYN P07948 3/20 0.78
HCK P08631 3/20 0.78
KIT P10721 3/20 0.78
BCR P11274 3/20 0.78
MAPK14 Q16539 3/20 0.78
PKMYT1 Q99640 3/20 0.78
EPHB6 O15197 2/20 0.78
CSF1R P07333 2/20 0.78
RET P07949 2/20 0.78
BRAF P15056 2/20 0.78
EPHA1 P21709 2/20 0.78
EPHA2 P29317 2/20 0.78
EPHA3 P29320 2/20 0.78
EPHA8 P29322 2/20 0.78

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
SCHEMBL773489 0.94 LCK (1.00) LCKABL1SRCEGFRFYN
SCHEMBL20042596 0.90 LCK (0.84) LCKABL1SRCEGFRFYN
SCHEMBL13626293 0.90 ABL1 (0.89) LCKABL1SRCEGFRFYN
SCHEMBL23514174 0.90 SIK2 (0.76) LCKABL1SRCEGFRFYN
SCHEMBL20048491 0.89 LCK (0.70) LCKABL1SRCEGFRFYN
SCHEMBL773969 0.89 LCK (0.82) LCKABL1SRCEGFRFYN
SCHEMBL20042552 0.88 ABL1 (0.86) LCKABL1SRCEGFRFYN
Dasatinib Anhydrous SCHEMBL28350326 0.88 ABL1 (1.00) LCKABL1SRCEGFRFYN
Dasatinib Anhydrous SCHEMBL29381185 0.88 ABL1 (1.00) LCKABL1SRCEGFRFYN
Dasatinib Anhydrous SCHEMBL8226 0.88 ABL1 (1.00) LCKABL1SRCEGFRFYN

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-20230287510-A1 COMPOSITIONS, PANELS, AND METHODS FOR CHARACTERIZING CHRONIC LYMPHOCYTIC LEUKEMIA THE BROAD INSTITUTE, INC. (US) 2023-09-14 US disclosed
US-10800771-B2 Process for the preparation of dasatinib polymorph NATCO PHARMA LIMITED (IN) 2020-10-13 US disclosed
US-20190292177-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF DASATINIB POLYMORPH NATCO PHARMA LIMITED (IN) 2019-09-26 US 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-10800771-B2 Process for the preparation of dasatinib polymorph ABL1, NOP56, SRSF6 LCK 314/4885ABL1 1/4885SRC 74/4885
US-20190292177-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF DASATINIB POLYMORPH NOP56, ABL1, SRSF6 LCK 315/4885ABL1 2/4885SRC 106/4885
US-20230287510-A1 COMPOSITIONS, PANELS, AND METHODS FOR CHARACTERIZING CHRONIC LYMPHOCYTIC LEUKEMIA BCL9, BCL9L, BCL6B LCK 974/4885ABL1 84/4885SRC 1588/4885

“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.