SCHEMBL28668391

SCHEMBL28668391

CC(=O)Cn1cc(-c2ccc(N)cc2)c2c(N)ncnc21

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 9/20 0.54
▸ LCK P06239 5/20 0.51
▸ TEK Q02763 5/20 0.51
▸ FLT3 P36888 7/20 0.50
▸ KDR P35968 6/20 0.50
▸ EGFR P00533 1/20 0.46
▸ RET P07949 1/20 0.44
▸ KIF5B P33176 1/20 0.44

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
SCHEMBL30569236 1.00 SRC (0.54) SRCLCKTEKFLT3KDR
SCHEMBL20351492 0.83 SRC (0.56) SRCLCKTEKFLT3KDR
SCHEMBL28928813 0.82 SRC (0.44) SRCLCKFLT3KDRRET
SCHEMBL30569271 0.82 SRC (0.44) SRCLCKFLT3KDRRET
SCHEMBL30569256 0.82 SRC (0.72) SRCLCKTEKFLT3KDR
SCHEMBL28667962 0.82 SRC (0.72) SRCLCKTEKFLT3KDR
SCHEMBL20351773 0.81 SRC (0.57) SRCLCKTEKFLT3KDR
SCHEMBL30569281 0.80 SRC (0.63) SRCLCKTEKFLT3KDR
SCHEMBL28668000 0.80 SRC (0.63) SRCLCKTEKFLT3KDR
SCHEMBL30569295 0.80 RET (0.56) SRCLCKTEKFLT3KDR

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-113683629-B Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2023-07-04 — — CN disclosed
CN-113683629-A Substituted heteroaryl compounds, compositions and uses thereof 北京范恩柯尔生物科技有限公司 2021-11-23 — — CN disclosed
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