SCHEMBL6229253

SCHEMBL6229253

CCNC(=O)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.65
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPSR1 Q6W5P4 1/20 0.52
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL15682958 0.84 FAAH (0.67) FAAH
SCHEMBL11055180 0.83 FAAH (0.55) FAAHCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL10877406 0.82 FAAH (0.50) FAAHCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL12043581 0.82 FAAH (0.46) FAAH
SCHEMBL2364382 0.81 KIF11 (0.50) FAAHALDH1A1
SCHEMBL10887890 0.81 FAAH (0.49) FAAHNPSR1KDM4EALDH1A1POLB
SCHEMBL7606599 0.80 NPC1 (0.45) NPSR1
SCHEMBL1799848 0.80 ACHE (0.56) FAAHCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL9126647 0.80 ESR1 (0.53) FAAHCYP3A4TSHRALDH1A1
SCHEMBL15765735 0.80 KDM4E (0.57) FAAHNPSR1KDM4E

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
EP-1590321-A2 ARYL ALKYL CARBAMATE DERIVATIVES PRODUCTION AND USE THEREOF IN THERAPY Sanofi-Aventis (FR) 2005-11-02 EP disclosed
WO-2004067498-A2 ARYL ALKYL CARBAMATE DERIVATIVES PRODUCTION AND USE THEREOF IN THERAPY SANOFI-AVENTIS (FR) 2004-08-12 WO disclosed