SCHEMBL27635585

SCHEMBL27635585

NC(CCCC[C@@H](C(=O)O)C(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC1A1 P43005 4/20 0.50
▸ SLC1A3 P43003 3/20 0.50
▸ ALPI P09923 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ XIAP P98170 1/20 0.49
▸ SLC7A5 Q01650 1/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ DPP8 Q6V1X1 1/20 0.46
▸ DPP7 Q9UHL4 1/20 0.46
▸ LTA4H P09960 3/20 0.46
▸ SLC15A1 P46059 1/20 0.46
▸ GRIK1 P39086 1/20 0.46
▸ SLC1A2 P43004 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 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
SCHEMBL27635584 1.00 SLC1A1 (0.50) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL30466149 0.88 SLC1A1 (0.52) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL10994023 0.88 SLC1A1 (0.52) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL676303 0.88 SLC1A1 (0.52) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL10591983 0.88 SLC1A1 (0.52) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL7754254 0.88 SLC1A1 (0.52) SLC1A1SLC1A3ALPIPKMPTGS1
SCHEMBL5241716 0.86 LTA4H (0.48) KMT2ATDP1LTA4HALDH1A1
SCHEMBL4384791 0.85 ITGB3 (0.49) KMT2ATDP1LTA4HALDH1A1
SCHEMBL7166074 0.85 ITGB3 (0.49) KMT2ATDP1LTA4HALDH1A1
SCHEMBL27559709 0.85 TDP1 (0.50) SLC1A1SLC1A3KMT2ATDP1DPP8

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
CN-1839121-A Hydroxamic acid compounds and methods of use thereof SLOAN KETTERING INST CANCER (US) 2006-09-27 — — CN disclosed
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