SCHEMBL29470163

SCHEMBL29470163

CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 8/20 0.71
▸ ECE1 P42892 6/20 0.70
▸ ACE P12821 2/20 0.66
▸ IL1RN P18510 8/20 0.65
▸ ERAP1 Q9NZ08 4/20 0.65

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
SCHEMBL29470162 1.00 ERAP2 (0.71) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30903446 0.95 ERAP2 (0.66) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL29531545 0.94 ERAP2 (0.73) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30051690 0.94 ERAP2 (0.73) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL29531276 0.94 ERAP2 (0.73) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30051546 0.94 ERAP2 (0.73) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL31247322 0.92 ERAP2 (0.66) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL30946945 0.92 ECE1 (0.70) ERAP2ECE1ACEIL1RNERAP1
SCHEMBL5583846 0.92 ACE (0.69) ERAP2ECE1ACE
SCHEMBL5583849 0.92 ACE (0.69) ERAP2ECE1ACE

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
US-20230320967-A1 COMPOSITION, USE OF THE COMPOSITION, COSMETIC METHOD FOR MODULATING THE PRODUCTION OF SEBUM CHEMYUNION LTDA. (BR) 2023-10-12 — — US disclosed
EP-4215178-A1 COMPOSITION, USE OF THE COMPOSITION, COSMETIC METHOD AND METHOD FOR MODULATING THE PRODUCTION OF SEBUM Chemyunion Ltda (BR) 2023-07-26 — — EP disclosed
WO-2022051831-A1 COMPOSITION, USE OF THE COMPOSITION, COSMETIC METHOD AND METHOD FOR MODULATING THE PRODUCTION OF SEBUM CHEMYUNION LTDA. (BR) 2022-03-17 — — WO disclosed
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