SCHEMBL7339398

SCHEMBL7339398

CC(C)(NC(=O)C(Cc1ccc(OCc2ccccc2)cc1)NC(=O)[CH]Cc1ccc(O)cc1)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
PPARG P37231 4/20 0.48
MME P08473 1/20 0.45
ACE P12821 1/20 0.45
CPA1 P15085 1/20 0.45
ACE2 Q9BYF1 1/20 0.45
BCL2 P10415 1/20 0.44
ERAP2 Q6P179 2/20 0.44
IL1RN P18510 1/20 0.44
ERAP1 Q9NZ08 1/20 0.44
LNPEP Q9UIQ6 1/20 0.43
LTA4H P09960 1/20 0.42
GPR34 Q9UPC5 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
YAP1 P46937 1/20 0.41
REN P00797 1/20 0.41

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
SCHEMBL7341060 0.86 MMP9 (0.47) MMP9MMP8PPARGMMEACE
SCHEMBL2860635 0.83 KDM4E (0.49) PPARGLTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL7342073 0.82 PPARG (0.50) MMP9MMP8PPARGMMEACE
SCHEMBL7338154 0.79 PPARG (0.51) MMP9MMP8PPARGMMEACE
SCHEMBL7339686 0.79 PPARG (0.49) MMP9MMP8PPARGMMEACE
SCHEMBL7346029 0.79 PPARG (0.49) MMP9MMP8PPARGMMEACE
SCHEMBL7344105 0.78 MMP9 (0.48) MMP9MMP8PPARGMMEACE
SCHEMBL7339406 0.77 LNPEP (0.55) MMP9MMP8PPARGMMEACE
SCHEMBL7368375 0.74 KDM4E (0.46) PPARGLTA4HNPC1RAB9ASMN1; SMN2
SCHEMBL7337451 0.74 PPARG (0.48) MMP9MMP8PPARGMMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US claimed
US-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US disclosed