SCHEMBL15061773

SCHEMBL15061773

C[C@@H](N)C(=O)NCC(CNC(=O)[C@@H](C)N)OC(=O)CCCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.51
TLR2 O60603 3/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
MGLL Q99685 1/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.46
FAAH O00519 4/20 0.46
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
LPAR1 Q92633 3/20 0.44

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
SCHEMBL15048928 1.00 HPGD (0.51) HPGDTLR2CYP2D6CYP2C9CYP2C19
SCHEMBL27741870 0.80 FAAH (0.54) HPGDKMT2AMGLLLMNAPKM
SCHEMBL15061853 0.80 TLR2 (0.48) HPGDTLR2KMT2AMGLLFAAH
SCHEMBL15048720 0.80 TLR2 (0.48) HPGDTLR2KMT2AMGLLFAAH
SCHEMBL15061768 0.79 HPGD (0.57) HPGDCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL15061775 0.79 HPGD (0.67) HPGDCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL10423181 0.77 KMT2A (0.77) HPGDCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL10627851 0.77 KMT2A (0.77) HPGDCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL10611159 0.77 KMT2A (0.77) HPGDCYP2D6CYP2C9CYP2C19KMT2A
SCHEMBL11800230 0.76 TSHR (0.64) HPGDKMT2AMGLLLMNAPKM

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-2607367-A1 Glycerol phenyl butyrate derivatives Lunamed AG (CH) 2013-06-26 EP disclosed