SCHEMBL21280059

SCHEMBL21280059

C=C1C(=O)OC(CCCCCCCC)C1C

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.63
▸ FASN P49327 1/20 0.63
▸ KAT2A Q92830 3/20 0.45
▸ CYP1A2 P05177 2/20 0.40
▸ DAGLA Q9Y4D2 1/20 0.40
▸ LYPLA1 O75608 2/20 0.39
▸ LYPLA2 O95372 2/20 0.39

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
SCHEMBL3947470 0.85 KAT2A (0.59) POLBFASNKAT2A
SCHEMBL13044449 0.79 POLB (0.58) POLBFASNKAT2ACYP1A2DAGLA
SCHEMBL10367622 0.78 DAGLA (0.51) POLBFASNCYP1A2DAGLALYPLA1
SCHEMBL22571236 0.78 DAGLA (0.51) POLBFASNCYP1A2DAGLALYPLA1
SCHEMBL24767125 0.78 POLB (0.61) POLBFASNKAT2ACYP1A2DAGLA
SCHEMBL7913818 0.78 POLB (1.00) POLBFASNKAT2ADAGLA
SCHEMBL17787714 0.78 POLB (1.00) POLBFASNKAT2ADAGLA
SCHEMBL7920757 0.78 POLB (1.00) POLBFASNKAT2ADAGLA
Protolichesterinic Acid SCHEMBL7913878 0.78 POLB (1.00) POLBFASNKAT2ADAGLA
SCHEMBL6428922 0.78 POLB (1.00) POLBFASNKAT2ADAGLA

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-3527657-A1 UNDIFFERENTIATED STEM CELL-REMOVING AGENT, AND METHOD FOR REMOVING UNDIFFERENTIATED STEM CELLS Keio University (JP) 2019-08-21 — — EP disclosed
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