SCHEMBL30477176

SCHEMBL30477176

CCC(COCC(CC)(COC(=O)CCC(=O)O)COC(=O)CCC(=O)O)(COC(=O)CCC(=O)O)COC(=O)CCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.41
EGLN1 Q9GZT9 2/20 0.38
KDM6B O15054 1/20 0.38
KDM5C P41229 1/20 0.38
PHF8 Q9UPP1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
LMNA P02545 3/20 0.36
PAM P19021 2/20 0.34
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
CYP2C19 P33261 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL12809711 0.88 LMNA (0.40) EGLN1KDM6BKDM5CPHF8KDM2A
SCHEMBL12781306 0.86 THRB (0.44) THRBEGLN1KDM6BKDM5CPHF8
SCHEMBL28886695 0.86 EGLN1 (0.36) THRBEGLN1KDM6BKDM5CPHF8
SCHEMBL542102 0.85 EGLN1 (0.38) THRBEGLN1KDM6BKDM5CPHF8
SCHEMBL13292134 0.85 PAM (0.44) THRBPAMALDH1A1MEN1KMT2A
SCHEMBL27090138 0.84 THRB (0.40) THRBALDH1A1TSHRADRA2AADRA1A
SCHEMBL16351307 0.83 THRB (0.42) THRBLMNAPAMFFAR3HDAC3
SCHEMBL26837829 0.83 KDM6B (0.34) THRBEGLN1KDM6BKDM5CPHF8
SCHEMBL11912289 0.82 LMNA (0.45) EGLN1KDM6BKDM5CPHF8KDM2A
SCHEMBL1405339 0.82 LMNA (0.45) EGLN1KDM6BKDM5CPHF8KDM2A

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-4164783-A1 POLYAMIDE MICROCAPSULES Firmenich SA (CH) 2023-04-19 EP disclosed