SCHEMBL13745767

SCHEMBL13745767

CC(C)(C)OC(=O)N1CCCC1C(=O)NCC(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
PRCP P42785 1/20 0.55
KLK7 P49862 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CMA1 P23946 1/20 0.54
TSHR P16473 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 1/20 0.53
CYP2C9 P11712 1/20 0.53
RAB9A P51151 1/20 0.53
CTRB1 P17538 1/20 0.52
GFER P55789 1/20 0.52
NPC1 O15118 1/20 0.52

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
SCHEMBL5494817 1.00 KMT2A (0.58) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL30689109 0.89 CMA1 (0.56) KMT2AMEN1PRCPKLK7NPSR1
SCHEMBL31420576 0.88 PRCP (0.58) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL17335864 0.88 PRCP (0.63) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL18875499 0.88 PRCP (0.63) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL5964139 0.88 CMA1 (0.48) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL5964142 0.88 CMA1 (0.48) KMT2AMEN1PRCPKLK7SMN1; SMN2
SCHEMBL5248179 0.87 KLK7 (0.56) KMT2AMEN1KLK7NPSR1ALDH1A1
SCHEMBL11033240 0.87 HTT (0.53) KMT2AMEN1SMN1; SMN2HTTCMA1
SCHEMBL4228972 0.86 KMT2A (0.59) KMT2AMEN1PRCPKLK7NPSR1

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-2009100360-A1 STABILIZATION OF THE COLLAGEN TRIPLE HELIX BY O-METHYLATION OF HYDROXYPROLINE RESIDUES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-08-13 WO disclosed