SCHEMBL28627632

SCHEMBL28627632

CC(C)(C)OC(=O)N1CCCC(n2cc(C(=O)O)c3c(N)ncnc32)C1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.66
EGFR P00533 3/20 0.66
ABL1 P00519 2/20 0.59
ABL2 P42684 2/20 0.59
BTK Q06187 3/20 0.47
RET P07949 3/20 0.45

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
SCHEMBL28627629 1.00 SRC (0.66) SRCEGFRABL1ABL2BTK
SCHEMBL29926654 1.00 SRC (0.66) SRCEGFRABL1ABL2BTK
SCHEMBL19731370 0.89 SRC (0.66) SRCEGFRABL1ABL2BTK
SCHEMBL14637043 0.88 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL13857886 0.88 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL15913719 0.88 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL13858167 0.88 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL30806175 0.88 SRC (0.65) SRCEGFRABL1ABL2BTK
SCHEMBL8108635 0.85 SRC (0.90) SRCEGFRABL1ABL2BTK
SCHEMBL19731457 0.82 SRC (0.73) SRCEGFRABL1ABL2

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
CN-113336760-B Substituted amide derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2022-11-04 CN disclosed
CN-113336760-A Substituted amide derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2021-09-03 CN disclosed