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SCHEMBL10995376

SCHEMBL10995376

CCCCCCCCOC(=O)NC1CCC(CC2CCC(NC(=O)OCCCCCCCC)CC2)CC1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.60
▸ MAPK1 P28482 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ EPHX1 P07099 2/20 0.52
▸ NAAA Q02083 3/20 0.51
▸ ACHE P22303 6/20 0.46
▸ EPHX2 P34913 1/20 0.44
▸ CNR1 P21554 1/20 0.43
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL1111487 0.94 GAA (0.52) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16544772 0.92 GAA (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL10793711 0.92 GAA (0.68) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16526220 0.91 GAA (0.66) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL18124429 0.87 EPHX1 (0.46) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL12603054 0.86 EPHX1 (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL4719490 0.85 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL13387564 0.85 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL20139065 0.85 HTT (0.46) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL23901023 0.85 GAA (0.60) GAAMAPK1HTTSMN1; SMN2EPHX1

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
US-4497963-A ETHYLENICALLY UNSATURADED POLYMERS BASF AKTIENGESELLSCHAFT (DE) 1985-02-05 — — US disclosed