SCHEMBL20535700

SCHEMBL20535700

CCCCCCCCCCCCCCCCCB1OC(C)(C)C(C)(C)O1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPL P06858 5/20 0.42
LIPG Q9Y5X9 5/20 0.42
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.38
DNM1 Q05193 5/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HSD17B10 Q99714 1/20 0.31
SLC22A1 O15245 1/20 0.31

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
SCHEMBL15928015 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL20139091 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL15927978 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL15923410 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL21293904 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL6938183 1.00 LPL (0.42) LPLLIPGTSHRTHRBDNM1
SCHEMBL18387576 0.90 LPL (0.37) LPLLIPGTSHRLMNA
SCHEMBL23969676 0.90 ANPEP (0.31) LPLLIPG
SCHEMBL20535258 0.88 FAAH (0.44) LMNAMEN1KMT2AHSD17B10
SCHEMBL20535262 0.88 FAAH (0.44) LMNAMEN1KMT2AHSD17B10

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-2018189157-A1 METHODS FOR PREPARING A BORONIC ACID OR A BORONIC ESTER THE UNIVERSITY OF BRISTOL (GB) 2018-10-18 WO disclosed