SCHEMBL28067928

SCHEMBL28067928

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CC(=O)OCCCCCC)C(=O)OCCCCCCCCCC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 6/20 0.56
KMT2A Q03164 3/20 0.51
FAAH O00519 2/20 0.50
MEN1 O00255 1/20 0.50
MAPK1 P28482 1/20 0.50
NAAA Q02083 1/20 0.49
DGKA P23743 1/20 0.49
POLB P06746 1/20 0.46
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
DNM1 Q05193 1/20 0.45

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
SCHEMBL9442141 1.00 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL27938456 1.00 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL18889562 0.94 NOD1 (0.51) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL8015419 0.92 KMT2A (0.49) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL13213983 0.91 NOD1 (0.49) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL27915658 0.90 NOD1 (0.62) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL27915675 0.90 NOD1 (0.62) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL27915537 0.90 NOD1 (0.62) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL8015603 0.90 NOD1 (0.62) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL27915544 0.90 NOD1 (0.62) NOD1KMT2AFAAHMEN1MAPK1

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
CN-103338743-B A kind of Cleasing compositions of stiff SUZHOU YUANSUJI CHEMICAL INDUSTRY Co.,Ltd. (CN) 2016-06-01 CN claimed
CN-103338743-B A kind of Cleasing compositions of stiff SUZHOU YUANSUJI CHEMICAL INDUSTRY Co.,Ltd. (CN) 2016-06-01 CN disclosed