SCHEMBL29976188

SCHEMBL29976188

CCCCCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 7/20 0.50
▸ EPHX2 P34913 2/20 0.50
▸ KMT2A Q03164 2/20 0.47
▸ FAAH O00519 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ PLA2G2C Q5R387 1/20 0.47
▸ PLA2G10 O15496 2/20 0.44
▸ DNM1 Q05193 1/20 0.43
▸ LPAR3 Q9UBY5 2/20 0.41
▸ SLC6A5 Q9Y345 1/20 0.41

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
SCHEMBL17746974 0.89 KMT2A (0.43) NOD1EPHX2KMT2A
SCHEMBL17746976 0.89 KMT2A (0.43) NOD1EPHX2KMT2A
SCHEMBL1959616 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL32889378 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL29669622 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL15387262 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL17747068 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL1960769 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL1958048 0.88 NOD1 (0.56) NOD1KMT2AFAAHMEN1MAPK1
SCHEMBL29669584 0.88 NOD1 (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3075247-B1 CONJUGATES FOR CANCER THERAPY AND DIAGNOSIS BIOSIGHT LTD (IL) 2022-10-12 — — EP disclosed
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