SCHEMBL8573383

SCHEMBL8573383

CCCC(=O)c1c(O)cc(OC)c(CCCC(=O)C2=C(O)C(C)(C)C(O)=C(C)C2=O)c1O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 3/20 0.51
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ PAK1 Q13153 1/20 0.45
▸ FFAR1 O14842 1/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ PLA2G5 P39877 1/20 0.37
▸ ALOX5 P09917 6/20 0.35
▸ PTGES O14684 1/20 0.35
▸ CYP19A1 P11511 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ RECQL P46063 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.33
▸ SENP7 Q9BQF6 1/20 0.33
▸ SENP6 Q9GZR1 1/20 0.33
▸ HMGCR P04035 1/20 0.33

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
Desaspidin SCHEMBL2732746 0.83 FASN (0.51) FASNMEN1KMT2APAK1FFAR1
Desaspidin SCHEMBL29613713 0.83 FASN (0.51) FASNMEN1KMT2APAK1FFAR1
SCHEMBL8904640 0.82 FASN (0.38) FASNFFAR1PLA2G2APLA2G5
SCHEMBL8571259 0.80 FASN (0.51) FASNFFAR1PLA2G2APLA2G5ALOX5
SCHEMBL29387296 0.76 FASN (0.59) FASNMEN1KMT2APAK1FFAR1
Desaspidin SCHEMBL28086151 0.75 FASN (0.42) FASNMEN1KMT2APAK1CYP19A1
SCHEMBL30212085 0.72 FASN (0.66) FASNMEN1KMT2APAK1ALOX5
SCHEMBL30212080 0.72 FASN (0.66) FASNMEN1KMT2APAK1ALOX5
SCHEMBL29929654 0.69 FASN (1.00) FASNMEN1KMT2APAK1FFAR1
SCHEMBL154937 0.69 FASN (1.00) FASNMEN1KMT2APAK1FFAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5807898-A ASPIDIN, DESASPIDIN, METHYLENEBISASPIDINOL KAPADIA GOVIND J (US) 1998-09-15 — — US disclosed
US-5684035-A NAPHTHOQUINONES KAPADIA GOVIND J (US) 1997-11-04 — — US disclosed
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