SCHEMBL9178463

SCHEMBL9178463

CCOC(=O)C(=O)[C@@H]1CCCN1C(=O)CCC(=O)N(Cc1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE P12821 13/20 0.43
ACE2 Q9BYF1 3/20 0.43
CPT2 P23786 1/20 0.43
CPT1A P50416 1/20 0.43
LMNA P02545 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 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
SCHEMBL8994520 0.91 KDM4E (0.44) ACEACE2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7306289 0.89 ACE (0.47) ACEACE2CPT2CPT1ACHRM2
SCHEMBL7290318 0.88 CPT2 (0.51) ACEACE2CPT2CPT1ASMN1; SMN2
SCHEMBL9182343 0.88 CPT2 (0.51) ACEACE2CPT2CPT1ASMN1; SMN2
SCHEMBL9185740 0.85 MEN1 (0.46) ACEACE2CPT2CPT1ATSHR
SCHEMBL9484859 0.85 ACE (0.56) ACEACE2CHRM2CHRM1CHRM3
SCHEMBL7283951 0.82 F2 (0.43) ACESMN1; SMN2ALDH1A1
SCHEMBL8306955 0.81 CPT2 (0.50) ACECPT2CPT1ALMNATSHR
SCHEMBL9871268 0.80 PREP (0.56) ACEACE2ALDH1A1
SCHEMBL9257303 0.80 MEN1 (0.52) ACEACE2LMNAALDH1A1

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
US-5401760-A Thiazoline derivative for treating amnesia ONO PHARMACEUTICAL CO., LTD. (JP) 1995-03-28 US disclosed