SCHEMBL15310072

SCHEMBL15310072

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

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.43
MEN1 O00255 6/20 0.43
PSMD14 O00487 1/20 0.43
CPT1A P50416 9/20 0.42
POLB P06746 1/20 0.41
CPT2 P23786 7/20 0.40
FFAR1 O14842 1/20 0.38
GYS1 P13807 1/20 0.37

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
SCHEMBL15310073 0.91 CPT1A (0.41) KMT2AMEN1PSMD14CPT1ACPT2
SCHEMBL2223315 0.91 GYS1 (0.44) KMT2ACPT1ACPT2GYS1
SCHEMBL14777269 0.91 GYS1 (0.44) KMT2ACPT1ACPT2GYS1
SCHEMBL15309861 0.87 POLB (0.42) KMT2AMEN1CPT1APOLB
SCHEMBL15309858 0.86 KMT2A (0.42) KMT2ACPT1ACPT2GYS1
SCHEMBL2224648 0.85 S1PR1 (0.51) KMT2AMEN1PSMD14CPT1ACPT2
SCHEMBL14777535 0.85 S1PR1 (0.51) KMT2AMEN1PSMD14CPT1ACPT2
SCHEMBL15309978 0.85 HPGD (0.41) KMT2AMEN1CPT1APOLB
SCHEMBL14777954 0.84 KMT2A (0.44) KMT2ACPT1AGYS1
SCHEMBL2223287 0.84 KMT2A (0.44) KMT2ACPT1AGYS1

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