SCHEMBL9666535

SCHEMBL9666535

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 8/20 0.63
▸ PLA2G2C Q5R387 1/20 0.63
▸ PLA2G10 O15496 2/20 0.58
▸ FAAH O00519 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ DNM1 Q05193 1/20 0.51
▸ SLC6A5 Q9Y345 2/20 0.51
▸ HSP90AA1 P07900 1/20 0.49
▸ GPR84 Q9NQS5 2/20 0.48
▸ PPARG P37231 2/20 0.48
▸ PPARD Q03181 2/20 0.48
▸ PPARA Q07869 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ SLC22A6 Q4U2R8 1/20 0.48
▸ SLC22A8 Q8TCC7 1/20 0.48
▸ TLR2 O60603 1/20 0.48
▸ HDAC11 Q96DB2 1/20 0.48

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
SCHEMBL9666567 1.00 NOD1 (0.63) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL6720390 1.00 NOD1 (0.63) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL6720391 1.00 NOD1 (0.63) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL9666508 1.00 NOD1 (0.63) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL9521809 1.00 NOD1 (0.63) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL9664662 0.98 NOD1 (0.60) NOD1PLA2G2CPLA2G10FAAHMEN1
Dodecanoate SCHEMBL7192839 0.92 NOD1 (0.61) NOD1PLA2G2CPLA2G10MEN1KMT2A
SCHEMBL18122065 0.92 NOD1 (0.61) NOD1PLA2G2CPLA2G10MEN1KMT2A
SCHEMBL26081237 0.91 TLR2 (0.59) NOD1PLA2G2CPLA2G10FAAHMEN1
SCHEMBL19724151 0.90 NOD1 (0.49) NOD1PLA2G2CPLA2G10KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0473700-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1992-03-11 — — EP claimed
WO-1990014429-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1990-11-29 — — WO claimed
EP-0473700-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1992-03-11 — — EP disclosed
WO-1990014429-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1990-11-29 — — WO disclosed
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