SCHEMBL18760195

SCHEMBL18760195

O=C(O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCCCNc1ccccc1)NC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.42
▸ NMT1 P30419 11/20 0.39
▸ NMT2 O60551 10/20 0.39
▸ EPHX2 P34913 2/20 0.38
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2A Q12879 1/20 0.36
▸ MMP1 P03956 2/20 0.35
▸ MMP2 P08253 2/20 0.35
▸ MMP3 P08254 2/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ NCOR2 Q9Y618 1/20 0.35

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
SCHEMBL18786235 0.99 EPHX1 (0.40) EPHX1NMT1NMT2EPHX2GRIN1
SCHEMBL18760191 0.96 NMT1 (0.44) EPHX1NMT1NMT2GRIN1GRIN2A
SCHEMBL23840117 0.93 NMT1 (0.40) EPHX1NMT1NMT2
SCHEMBL22223575 0.93 EPHX1 (0.41) EPHX1NMT1NMT2EPHX2HDAC1
SCHEMBL18785521 0.86 NMT1 (0.37) NMT1NMT2MMP1MMP3
SCHEMBL20634648 0.85 NMT1 (0.42) NMT1NMT2EPHX2
SCHEMBL23840130 0.85 NMT1 (0.42) NMT1NMT2EPHX2
SCHEMBL20633489 0.83 NMT1 (0.41) NMT1NMT2
SCHEMBL23840017 0.83 NMT1 (0.46) NMT1NMT2
SCHEMBL18760192 0.83 NMT1 (0.46) NMT1NMT2

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-2017066349-A1 VE-CADHERIN BINDING BIOCONJUGATE SYMIC IP, LLC (US) 2017-04-20 — — WO disclosed
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