SCHEMBL9511556

SCHEMBL9511556

CC(C)(C)OC(=O)N[C@H](CCSCCC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 3/20 0.49
▸ IDO1 P14902 1/20 0.46
▸ MDM4 O15151 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ PPARG P37231 3/20 0.45
▸ PPARA Q07869 3/20 0.45
▸ TNF P01375 3/20 0.44
▸ TLR2 O60603 2/20 0.44
▸ PPARD Q03181 2/20 0.43
▸ SLC17A5 Q9NRA2 1/20 0.42
▸ ACE P12821 1/20 0.42

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
SCHEMBL9511552 1.00 MDM2 (0.49) MDM2IDO1MDM4TP53PPARG
SCHEMBL18632610 0.93 MDM2 (0.51) MDM2MDM4TP53TNFTLR2
SCHEMBL20554036 0.93 MDM2 (0.51) MDM2MDM4TP53TNFTLR2
SCHEMBL29400768 0.90 MDM2 (0.53) MDM2IDO1MDM4TP53PPARG
SCHEMBL14381107 0.90 MDM2 (0.53) MDM2IDO1MDM4TP53PPARG
SCHEMBL10131781 0.90 MDM2 (0.53) MDM2IDO1MDM4TP53PPARG
SCHEMBL9514163 0.86 PPARG (0.51) MDM2IDO1MDM4TP53PPARG
SCHEMBL8350968 0.84 IDO1 (0.53) MDM2IDO1MDM4TP53PPARG
SCHEMBL29401813 0.84 IDO1 (0.53) MDM2IDO1MDM4TP53PPARG
SCHEMBL17079665 0.84 SLC17A5 (0.53) MDM2MDM4TP53PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320967-B1 ANF derivatives with novel bridging BIO MEGA BOEHRINGER INGELHEIM (CA) 1993-12-08 — — EP disclosed
US-4891358-A ATRIAL NATRIURETIC FACTOR BIO-MEGA INC. (CA) 1990-01-02 — — US disclosed
EP-0320967-A2 ANF derivatives with novel bridging BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1989-06-21 — — EP disclosed
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