SCHEMBL19731370

SCHEMBL19731370

Cc1cn(C2CCCN(C(=O)OC(C)(C)C)C2)c2ncnc(N)c12

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 16/20 0.66
EGFR P00533 3/20 0.66
ABL1 P00519 2/20 0.61
ABL2 P42684 2/20 0.61
BTK Q06187 2/20 0.46
FGFR1 P11362 1/20 0.46
FGFR4 P22455 1/20 0.46

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
SCHEMBL19731457 0.94 SRC (0.73) SRCEGFRABL1ABL2FGFR1
SCHEMBL19731356 0.90 SRC (0.61) SRCEGFRABL1ABL2
SCHEMBL14637043 0.89 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL15913719 0.89 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL30806175 0.89 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL13858167 0.89 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL13857886 0.89 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL28627629 0.89 SRC (0.66) SRCEGFRABL1ABL2BTK
SCHEMBL29926654 0.89 SRC (0.66) SRCEGFRABL1ABL2BTK
SCHEMBL28627632 0.89 SRC (0.66) SRCEGFRABL1ABL2BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3486244-A1 NEW COMPOUND HAVING FGFR INHIBITORY ACTIVITY AND PREPARATION AND APPLICATION THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2019-05-22 EP disclosed
WO-2017215485-A1 NEW COMPOUND HAVING FGFR INHIBITORY ACTIVITY AND PREPARATION AND APPLICATION THEREOF 中国科学院上海药物研究所 2017-12-21 WO disclosed