SCHEMBL14879286

SCHEMBL14879286

CCN(CC)CCOc1ccc(OC)c(NC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
CHRNA7 P36544 1/20 0.50
MCHR1 Q99705 1/20 0.48
HTT P42858 2/20 0.48
CYP1A2 P05177 1/20 0.48
LTA4H P09960 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 1/20 0.46
SMARCA2 P51531 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
MAOB P27338 1/20 0.46
KDM4E B2RXH2 1/20 0.46
TSHR P16473 1/20 0.46
EBP Q15125 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
LMNA P02545 1/20 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
SCHEMBL10358080 0.83 MAPT (0.56) MAPTKMT2ACHRNA7MCHR1HTT
SCHEMBL2968901 0.79 MAPT (0.53) MAPTKMT2ACHRNA7MCHR1HTT
SCHEMBL2966830 0.77 ALDH1A1 (0.53) MAPTKMT2ACHRNA7MCHR1HTT
SCHEMBL14879278 0.76 MAPT (0.55) MAPTMCHR1HTTKDM4ETSHR
SCHEMBL6811201 0.75 MCHR1 (0.58) MCHR1
SCHEMBL2969839 0.74 PRMT5 (0.54) MAPTKMT2ACHRNA7MCHR1SMN1; SMN2
SCHEMBL11880460 0.74 KDR (0.51) MCHR1HTTCYP1A2LTA4HCYP2D6
SCHEMBL1576523 0.74 GAA (0.59) MAPTKMT2ACYP2D6POLBSMN1; SMN2
SCHEMBL9706125 0.74 EBP (0.72) MAPTKMT2ACHRNA7MCHR1HTT
SCHEMBL4272107 0.73 CYP2D6 (0.61) MAPTKMT2ACHRNA7MCHR1HTT

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
EP-1802586-B1 HETEROARYL-SUBSTITUTED ALKYNE COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2013-04-24 EP disclosed