SCHEMBL8994561

SCHEMBL8994561

CC(C)COC(=O)C(=O)[C@@H]1CCCN1C(=O)CCC(=O)N(C)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.48
CPT1A P50416 1/20 0.48
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ACE P12821 10/20 0.43
ACE2 Q9BYF1 2/20 0.42
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TACR1 P25103 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL9182343 0.90 CPT2 (0.51) CPT2CPT1ANPC1RAB9AACE
SCHEMBL7290318 0.90 CPT2 (0.51) CPT2CPT1ANPC1RAB9AACE
SCHEMBL8306955 0.89 CPT2 (0.50) CPT2CPT1ANPC1RAB9AACE
SCHEMBL7282427 0.86 NPC1 (0.56) CPT2CPT1ANPC1RAB9AACE
Water SCHEMBL7282829 0.85 NPC1 (0.55) CPT2CPT1ANPC1RAB9AACE
SCHEMBL7291237 0.84 NPC1 (0.53) CPT2CPT1ANPC1RAB9AACE
SCHEMBL7294666 0.84 NPC1 (0.53) CPT2CPT1ANPC1RAB9AACE
SCHEMBL9485197 0.83 ACE (0.57) CPT2CPT1ANPC1RAB9AACE
SCHEMBL8994613 0.81 CCR1 (0.50) RAB9ASMN1; SMN2
SCHEMBL7283694 0.80 NPC1 (0.53) CPT2CPT1ANPC1RAB9AACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545657-A 1-ALKYLOYLPYRROLIDIN-2-YLOXOALKANOIC ACIDS AND DERIVATIVES; ANTIAMNESIA AGENTS; INHIBITORS OF PROLYL ENDOPEPTIDASE; SUPPRESSION OF NEUROTRANSMITTER METABOLISM ONO PHARMACEUTICAL CO., LTD. (JP) 1996-08-13 US disclosed
US-5401760-A Thiazoline derivative for treating amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1995-03-28 US disclosed
US-5212191-A Thiazoline derivatives for treatment of amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-18 US disclosed
US-5053414-A Thiazolidine derivatives, enzyme inhibitors; amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1991-10-01 US disclosed