SCHEMBL27314736

SCHEMBL27314736

OC(F)C1CC1c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.45
MAOA P21397 7/20 0.45
KDM1A O60341 5/20 0.45
CYP2C19 P33261 4/20 0.45
HTR2C P28335 4/20 0.45
CYP2B6 P20813 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
LMNA P02545 2/20 0.45
TAAR1 Q96RJ0 2/20 0.45
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
CYP2A6 P11509 1/20 0.45
SLC6A2 P23975 1/20 0.45
ADRA1A P35348 1/20 0.45
DRD3 P35462 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 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
SCHEMBL1990780 0.83 MAOB (0.48) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL27520569 0.80 KDM1A (0.48) MAOBMAOAKDM1AHTR2CSLC6A2
SCHEMBL12611380 0.79 SMN1; SMN2 (0.46) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL1786790 0.79 SMN1; SMN2 (0.46) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL12611241 0.79 SMN1; SMN2 (0.46) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL1786791 0.79 SMN1; SMN2 (0.46) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL10338410 0.79 MAOB (0.41) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL10338408 0.79 MAOB (0.41) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL18533592 0.75 SMN1; SMN2 (0.42) MAOBMAOAKDM1ACYP2C19HTR2C
SCHEMBL7086540 0.71 MAOB (0.50) MAOBMAOAKDM1ACYP2C19HTR2C

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-1027692-C Process for producing dienamide derivative ROUSSEL UCLAF CO (FR) 1995-02-22 CN disclosed
CN-1091423-A The pesticide composition that contains derivative of diene amide WELLCOME FOUND (GB) 1994-08-31 CN disclosed
CN-1045576-A Pesticide WELLCOME FOUND (GB) 1990-09-26 CN disclosed