SCHEMBL31434287

SCHEMBL31434287

CCN(CC)CCOc1ccc(C=O)nc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 3/20 0.53
▸ CYP1A2 P05177 1/20 0.50
▸ LTA4H P09960 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ MAPT P10636 1/20 0.49
▸ CHRNA7 P36544 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ EBP Q15125 1/20 0.48
▸ SIGMAR1 Q99720 1/20 0.48
▸ MAOB P27338 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
SCHEMBL20550900 1.00 MCHR1 (0.53) MCHR1CYP1A2LTA4HCYP2D6CYP2C9
SCHEMBL30786081 0.85 MCHR1 (0.53) MCHR1CYP1A2LTA4HCYP2D6CYP2C9
SCHEMBL19816984 0.84 CHRNB2 (0.45) LTA4H
SCHEMBL3386711 0.84 CHRNB2 (0.51) CYP1A2LTA4HCYP2D6CYP2C9CYP2C19
SCHEMBL7373164 0.82 CA12 (0.42) LTA4HCYP2C9HTTMAPTKMT2A
SCHEMBL8522859 0.82 MAPT (0.44) CYP1A2LTA4HCYP2D6CYP2C9CYP2C19
SCHEMBL870305 0.79 CYP1A2 (0.61) MCHR1CYP1A2LTA4HCYP2D6CYP2C9
SCHEMBL252784 0.79 GAA (0.39) MAPT
SCHEMBL934205 0.79 NQO1 (0.48) LTA4HKMT2A
SCHEMBL20489792 0.78 NCF1 (0.42) CYP1A2CYP2D6CYP2C19MAPT

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-119528804-A 2- { [2- (Phenoxymethyl) pyridin-5-yl ] oxy } ethanamine derivatives and related compounds as pest control agents, for example, for protecting plants 发现号收购集团 2025-02-28 — — CN disclosed
CN-119285538-A 2- { [2- (Phenoxymethyl) pyridin-5-yl ] oxy } ethanamine derivatives and related compounds as pest control agents, for example, for protecting plants 发现号收购集团 2025-01-10 — — CN disclosed
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