SCHEMBL30289682

SCHEMBL30289682

Nc1nccc2c(C3CCC(O)CC3)nc(-c3ccc(Oc4ccccc4)cc3)n12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 18/20 0.43
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
LCK P06239 1/20 0.38
SRC P12931 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
KDR P35968 1/20 0.38
PRKCI P41743 1/20 0.38
PRKCE Q02156 1/20 0.38
TEK Q02763 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCZ Q05513 1/20 0.38
PRKCD Q05655 1/20 0.38
PRKD1 Q15139 1/20 0.38
MAPK14 Q16539 1/20 0.37

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
SCHEMBL30289697 0.88 TNK2 (0.49) TNK2LCKSRCTEKMAPK14
SCHEMBL30289731 0.87 TNK2 (0.39) TNK2
SCHEMBL30289648 0.85 TNK2 (0.45) TNK2
SCHEMBL30289737 0.84 BTK (0.38) TNK2LCKSRCTEK
SCHEMBL30289644 0.84 BTK (0.47) TNK2
SCHEMBL30289669 0.84 TNK2 (0.38) TNK2
SCHEMBL30289599 0.83 BTK (0.48) TNK2
SCHEMBL30289565 0.83 TNK2 (0.38) TNK2
SCHEMBL30289668 0.83 TNK2 (0.38) TNK2
SCHEMBL30289603 0.83 TNK2 (0.38) TNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894497-A Imidazopyrimidine compounds, and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-04-04 CN disclosed