SCHEMBL9615375

SCHEMBL9615375

COC(=O)N(F)c1cccc(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.51
MTNR1B P49286 13/20 0.51
HSD17B2 P37059 2/20 0.48
HSD17B1 P14061 1/20 0.48
RAB9A P51151 2/20 0.48
TSHR P16473 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47

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
SCHEMBL1012749 0.85 MTNR1A (0.51) MTNR1AMTNR1BHSD17B2HSD17B1RAB9A
SCHEMBL27644903 0.85 MTNR1A (0.49) MTNR1AMTNR1BHSD17B2HSD17B1RAB9A
SCHEMBL27662593 0.85 MTNR1A (0.54) MTNR1AMTNR1BHSD17B2HSD17B1RAB9A
SCHEMBL1779795 0.84 MTNR1A (0.44) MTNR1AMTNR1BHSD17B2HSD17B1TSHR
SCHEMBL9835557 0.83 MTNR1A (0.48) MTNR1AMTNR1BHSD17B2HSD17B1RAB9A
SCHEMBL27931266 0.80 MTNR1A (0.51) MTNR1AMTNR1BHSD17B2HSD17B1CES2
SCHEMBL28111104 0.78 L3MBTL1 (0.47) TSHRNPSR1
SCHEMBL28129412 0.78 MTNR1A (0.52) MTNR1AMTNR1B
SCHEMBL4252189 0.76 ACHE (0.50) MTNR1AMTNR1BHSD17B2HSD17B1CES2
SCHEMBL20979821 0.76 ACHE (0.54) MTNR1AMTNR1BHSD17B2HSD17B1CES2

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
JP-4139162-A None JP disclosed
JP-H04139162-A CARBAMIC ACID ESTER DERIVATIVE AND ITS PRODUCTION CHISSO CORP 1992-05-13 JP disclosed