SCHEMBL29926356

SCHEMBL29926356

CCCCCC(=O)NCCc1c[nH]c2ccccc12

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.98
MEN1 O00255 2/20 0.81
KMT2A Q03164 2/20 0.81
TRPV1 Q8NER1 6/20 0.71
AANAT Q16613 1/20 0.67
LMNA P02545 2/20 0.66
CYP1A2 P05177 2/20 0.66
CYP2C19 P33261 2/20 0.66
PKM P14618 1/20 0.66
TSHR P16473 1/20 0.66
BLM P54132 1/20 0.66
ALDH1A1 P00352 1/20 0.64
MAPT P10636 2/20 0.62
UBE2N P61088 1/20 0.62
GFER P55789 1/20 0.62
FAAH O00519 1/20 0.60
PTGS2 P35354 1/20 0.60
CYP2D6 P10635 1/20 0.60
HPGD P15428 1/20 0.60
RECQL P46063 1/20 0.60

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
SCHEMBL1063483 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1726502 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL22411433 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1725354 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1724741 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL3806536 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1727281 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1726070 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL1066221 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT
SCHEMBL29376485 0.99 MTNR1A (1.00) MTNR1AMEN1KMT2ATRPV1AANAT

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
US-20230141310-A1 HUMAN GUT MICROBIOME-DERIVED BIOSYNTHETIC ENZYMES FOR PRODUCTION OF FATTY ACID AMIDES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-05-11 US disclosed
US-11441162-B2 Human gut microbiome-derived biosynthetic enzymes for production of fatty acid amides MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-09-13 US disclosed