SCHEMBL14037774

SCHEMBL14037774

CCCCCCCC/C=C/CCCCCCCC(=O)NC(CSSCC(N)C(=O)NCCCCCCCCCCCCCCCC)C(=O)NCCCCCCCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.56
▸ SLC6A5 Q9Y345 4/20 0.53
▸ LPAR3 Q9UBY5 4/20 0.50
▸ NOD1 Q9Y239 1/20 0.50
▸ LPAR1 Q92633 2/20 0.49
▸ TLR2 O60603 1/20 0.48
▸ FNTA P49354 2/20 0.48
▸ FNTB P49356 2/20 0.48
▸ CNR1 P21554 1/20 0.47
▸ PGGT1B P53609 1/20 0.47

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
SCHEMBL17930624 0.94 EPHX2 (0.61) EPHX2SLC6A5LPAR3LPAR1CNR1
SCHEMBL20687037 0.94 EPHX2 (0.61) EPHX2SLC6A5LPAR3LPAR1CNR1
SCHEMBL12514075 0.94 EPHX2 (0.61) EPHX2SLC6A5LPAR3LPAR1CNR1
SCHEMBL14703719 0.89 EPHX2 (0.56) EPHX2SLC6A5LPAR3LPAR1TLR2
SCHEMBL20542716 0.87 LPAR3 (0.62) EPHX2LPAR3NOD1LPAR1TLR2
SCHEMBL20542720 0.87 LPAR3 (0.62) EPHX2LPAR3NOD1LPAR1TLR2
SCHEMBL16214777 0.86 EPHX2 (0.55) EPHX2SLC6A5LPAR3LPAR1TLR2
SCHEMBL15462785 0.86 EPHX2 (0.55) EPHX2SLC6A5LPAR3LPAR1TLR2
SCHEMBL12148864 0.84 EPHX2 (0.60) EPHX2SLC6A5LPAR3LPAR1CNR1
SCHEMBL12148896 0.83 SLC6A5 (0.64) EPHX2SLC6A5LPAR3LPAR1CNR1

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
WO-2008137758-A2 AMINO ACID LIPIDS AND USES THEREOF MDRNA, INC. (US) 2008-11-13 — — WO disclosed
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