SCHEMBL2227123

SCHEMBL2227123

O=C(O)OC1CCN(C(=O)COc2ccc(-c3nc4cnc(Oc5ccccc5F)nc4o3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
CPT1A P50416 1/20 0.41
ACHE P22303 5/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FKBP1A P62942 2/20 0.40
LMNA P02545 1/20 0.40
S1PR1 P21453 1/20 0.38
KCNH2 Q12809 1/20 0.37
PKM P14618 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL2227122 0.91 POLB (0.46) HPGDMEN1KMT2APOLBCPT1A
SCHEMBL15309978 0.90 HPGD (0.41) HPGDMEN1KMT2APOLBCPT1A
SCHEMBL15310002 0.88 S1PR1 (0.52) HPGDPOLBCPT1AALDH1A1GAA
SCHEMBL2223318 0.88 CPT1A (0.41) CPT1AS1PR1
SCHEMBL15310300 0.87 HPGD (0.41) HPGDFKBP1AS1PR1
SCHEMBL15310033 0.84 S1PR1 (0.50) HPGDPOLBCPT1AALDH1A1GAA
SCHEMBL2226787 0.84 S1PR1 (0.51) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL2223315 0.83 GYS1 (0.44) KMT2ACPT1A
SCHEMBL14777269 0.83 GYS1 (0.44) KMT2ACPT1A
SCHEMBL15310137 0.82 S1PR1 (0.53) HPGDKMT2APOLBCPT1AGAA

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 6 patents. 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 claimed
EP-2523960-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP claimed
WO-2011086080-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO claimed
EP-2523960-B1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI SA (FR) 2013-10-16 EP disclosed
EP-2523960-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086080-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO disclosed