SCHEMBL17772132

SCHEMBL17772132

CC(CCCCCC1(C(=O)N=O)CC1)CCCCCC1(C(=O)N=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE2 Q9BYF1 1/20 0.36
▸ CYP4F2 P78329 1/20 0.36
▸ CYP4A11 Q02928 1/20 0.36
▸ BLM P54132 1/20 0.31
▸ LMNA P02545 1/20 0.30

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
SCHEMBL2737126 0.94 ACE2 (0.39) ACE2CYP4F2CYP4A11BLM
SCHEMBL17772130 0.83 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL17772115 0.73 CYP4F2 (0.35) CYP4F2CYP4A11
SCHEMBL17772121 0.70 CYP4F2 (0.41) ACE2CYP4F2CYP4A11BLM
SCHEMBL30959045 0.69 BLM (0.41) ACE2CYP4F2CYP4A11BLMLMNA
SCHEMBL31157055 0.69 BLM (0.41) ACE2CYP4F2CYP4A11BLMLMNA
SCHEMBL31157063 0.69 BLM (0.41) ACE2CYP4F2CYP4A11BLMLMNA
SCHEMBL31157050 0.69 BLM (0.41) ACE2CYP4F2CYP4A11BLMLMNA
SCHEMBL31157064 0.69 BLM (0.41) ACE2CYP4F2CYP4A11BLMLMNA
SCHEMBL2737164 0.69 ACACB (0.51) ACE2CYP4F2CYP4A11BLM

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
EP-2402300-B1 Hydroxyl compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS INC (US) 2016-05-25 — — EP disclosed
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