SCHEMBL15645841

SCHEMBL15645841

CSOC(=O)N1CCCCC1c1ccncn1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 9/20 0.40
PRMT5 O14744 2/20 0.39
WDR77 Q9BQA1 2/20 0.39
CPT2 P23786 5/20 0.38
HSD11B1 P28845 2/20 0.38
GPR119 Q8TDV5 1/20 0.38
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CPT1B Q92523 3/20 0.37
KDM5A P29375 1/20 0.36
GRM5 P41594 1/20 0.36
PRCP P42785 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL28292819 0.80 CPT1A (0.42) CPT1APRMT5WDR77CPT2CDK5
SCHEMBL12090215 0.72 CHRNB2 (0.51) KDM4EALDH1A1LMNA
SCHEMBL23853485 0.70 MAP4K4 (0.39) CPT1ACPT2KDM5AGRM5PRCP
SCHEMBL30781994 0.70 KDM5A (0.37) CPT1APRMT5WDR77GPR119CDK5
SCHEMBL15645839 0.69 GPR119 (0.35) CPT1APRMT5WDR77CPT2GPR119
SCHEMBL25063295 0.69 ALDH1A1 (0.41) KDM4EALDH1A1LMNA
SCHEMBL29491244 0.68 PRMT5 (0.55) CPT1APRMT5WDR77HSD11B1GPR119
SCHEMBL28814072 0.68 PRMT5 (0.55) CPT1APRMT5WDR77HSD11B1GPR119
SCHEMBL29021048 0.68 GPR119 (0.49) HSD11B1GPR119KDM4EALDH1A1LMNA
SCHEMBL12090398 0.68 CHRNA7 (0.50) ALDH1A1LMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014062938-A1 RORY MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-04-24 WO disclosed