SCHEMBL28057064

SCHEMBL28057064

CCNC(=O)c1cc(C#N)cc(Cl)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.40
▸ PRKCZ Q05513 1/20 0.39
▸ GRIN1 Q05586 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.38
▸ FLT1 P17948 1/20 0.38
▸ FLT4 P35916 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.37
▸ ELANE P08246 2/20 0.37
▸ P2RX7 Q99572 2/20 0.36
▸ HAT1 O14929 1/20 0.36
▸ EP300 Q09472 1/20 0.36
▸ FASN P49327 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SETD7 Q8WTS6 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ RECQL P46063 1/20 0.35

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
SCHEMBL28057063 0.84 HSP90AB1 (0.43) LMNAHSP90AB1GPR35FASNHPGD
SCHEMBL28056987 0.84 FLT1 (0.40) FLT1FLT4KDRGPR35POLB
SCHEMBL12670866 0.82 FLT1 (0.54) LMNAGRIN1GRIN2AFLT1FLT4
SCHEMBL13753818 0.80 LMNA (0.51) LMNAPRKCZHSP90AB1HPGDPOLB
SCHEMBL13753920 0.79 HSP90AB1 (0.44) LMNAGRIN1GRIN2AHSP90AB1ELANE
SCHEMBL27816654 0.77 AKR1C2 (0.41) FLT1FLT4KDRGPR35ALDH1A1
Diethylamine SCHEMBL10533129 0.77 LMNA (0.48) LMNAPRKCZHSP90AB1HPGDPOLB
SCHEMBL14976373 0.75 ADRA1D (0.34) FLT1FLT4KDRGPR35P2RX7
SCHEMBL2696430 0.74 NPC1 (0.44) P2RX7IRAK4
SCHEMBL14976051 0.74 FLT1 (0.34) FLT1FLT4KDRGPR35HPGD

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-105367548-A Cyan dihalogenation pyrazol amide series compound and preparation method and application thereof DENG FANGKUN 2016-03-02 — — CN disclosed
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