SCHEMBL29639613

SCHEMBL29639613

CCCCCCCC/C=C\CCCCCCCC(=O)NCc1cccc(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 1.00
FAAH O00519 5/20 1.00
CNR1 P21554 3/20 0.84
TRPV1 Q8NER1 2/20 0.68
MEN1 O00255 1/20 0.68
TP53 P04637 1/20 0.68
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2D6 P10635 1/20 0.68
MAPT P10636 1/20 0.68
HPGD P15428 1/20 0.68
MTOR P42345 1/20 0.68
KMT2A Q03164 1/20 0.68
CNR2 P34972 1/20 0.67

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
SCHEMBL22558561 1.00 EPHX2 (1.00) EPHX2FAAHCNR1TRPV1MEN1
SCHEMBL22558582 1.00 EPHX2 (1.00) EPHX2FAAHCNR1TRPV1MEN1
SCHEMBL20598982 0.98 EPHX2 (1.00) EPHX2FAAHCNR1CNR2
SCHEMBL22558609 0.98 EPHX2 (1.00) EPHX2FAAHCNR1CNR2
SCHEMBL29639614 0.98 EPHX2 (1.00) EPHX2FAAHCNR1CNR2
SCHEMBL31659466 0.98 EPHX2 (0.96) EPHX2FAAHCNR1TRPV1CNR2
SCHEMBL31659445 0.98 EPHX2 (0.96) EPHX2FAAHCNR1TRPV1CNR2
SCHEMBL28668554 0.93 EPHX2 (0.96) EPHX2FAAHCNR1TRPV1CNR2
SCHEMBL30541868 0.93 EPHX2 (1.00) EPHX2FAAHCNR1
SCHEMBL30541869 0.93 EPHX2 (1.00) EPHX2FAAHCNR1

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-116602949-A Application of maca amide compound in pharmacy and pharmaceutical preparation 武汉轻工大学 2023-08-18 CN claimed
CN-116602949-A Application of maca amide compound in pharmacy and pharmaceutical preparation 武汉轻工大学 2023-08-18 CN disclosed
US-20220202052-A1 AROMATIC ALKAMIDES AND METHODS OF USE THEREOF IN TASTE MODULATION INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2022-06-30 US disclosed