SCHEMBL15310073

SCHEMBL15310073

O=C(O)O[C@H]1CCCN1C(=O)COc1ccc(-c2nc3cnc(Oc4ccccc4F)nc3o2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 11/20 0.41
CPT2 P23786 6/20 0.38
FFAR1 O14842 1/20 0.37
PDK2 Q15119 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
PSMD14 O00487 1/20 0.35
S1PR1 P21453 1/20 0.35
PRCP P42785 1/20 0.35

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
SCHEMBL15310072 0.91 KMT2A (0.43) CPT1ACPT2FFAR1MEN1KMT2A
SCHEMBL2223318 0.90 CPT1A (0.41) CPT1ACPT2FFAR1S1PR1PRCP
SCHEMBL15309978 0.88 HPGD (0.41) CPT1APDK2MEN1KMT2AS1PR1
SCHEMBL15310017 0.86 CPT1A (0.38) CPT1ACPT2FFAR1MEN1KMT2A
SCHEMBL2224649 0.85 S1PR1 (0.51) CPT1ACPT2FFAR1S1PR1PRCP
SCHEMBL15309861 0.84 POLB (0.42) CPT1AMEN1KMT2A
SCHEMBL2223289 0.84 S1PR1 (0.42) CPT1ACPT2S1PR1PRCP
SCHEMBL15310209 0.83 S1PR1 (0.39) CPT1ACPT2S1PR1
SCHEMBL2223315 0.82 GYS1 (0.44) CPT1ACPT2KMT2A
SCHEMBL14777269 0.82 GYS1 (0.44) CPT1ACPT2KMT2A

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
EP-2523960-B1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI SA (FR) 2013-10-16 EP disclosed