SCHEMBL28015675

SCHEMBL28015675

CCC1(CC)c2cc(-c3ccncc3)ccc2-c2ccc(-c3ccncc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.48
▸ QDPR P09417 1/20 0.40
▸ ROCK2 O75116 2/20 0.40
▸ MAP4K4 O95819 2/20 0.40
▸ GSK3B P49841 2/20 0.40
▸ CLK4 Q9HAZ1 2/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ PRKACA P17612 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PDE3B Q13370 2/20 0.39
▸ PDE3A Q14432 2/20 0.39
▸ KIF11 P52732 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ AAK1 Q2M2I8 5/20 0.37
▸ PRMT6 Q96LA8 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
SCHEMBL15603741 0.82 PDK2 (0.43) PDK2ROCK2MAP4K4GSK3BCLK4
SCHEMBL8405373 0.81 CYP3A4 (0.44) PDK2QDPRROCK2MAP4K4GSK3B
SCHEMBL5387522 0.80 PDK2 (0.47) PDK2
SCHEMBL12937067 0.79 PDK2 (0.54) PDK2QDPRROCK2MAP4K4GSK3B
SCHEMBL12937079 0.79 PDK2 (0.54) PDK2QDPRROCK2MAP4K4GSK3B
SCHEMBL2129264 0.78 PDK2 (0.44) PDK2
SCHEMBL13858046 0.78 PDK2 (0.47) PDK2ROCK2MAP4K4GSK3BCLK4
SCHEMBL27973277 0.77 KIF11 (0.40) PDK2GSK3BKIF11
SCHEMBL28055711 0.77 PDK2 (0.51) PDK2MAPTLMNASMN1; SMN2
SCHEMBL14508375 0.76 PDK2 (0.37) PDK2SMN1; SMN2

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
CN-104628628-B A kind of fluorenes pyridine nano nickel particles and preparation method thereof 宁波大学 2019-07-02 — — CN claimed
CN-104628628-A Fluorene pyridine nickle nano-particles and preparation method thereof UNIV NINGBO 2015-05-20 — — CN claimed
CN-104628628-A Fluorene pyridine nickle nano-particles and preparation method thereof UNIV NINGBO 2015-05-20 — — CN disclosed
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