SCHEMBL6160915

SCHEMBL6160915

CCOC(=O)CC(=O)CC1CCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
TDP1 Q9NUW8 1/20 0.43
KMT2A Q03164 2/20 0.42
EPHX1 P07099 1/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
METAP2 P50579 1/20 0.38
EPHX2 P34913 1/20 0.38

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
SCHEMBL3106991 1.00 MGAM (0.48) MGAMGAASIMGAM2TDP1
SCHEMBL3109485 0.98 GAA (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL2555598 0.95 MGAM (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL1015154 0.91 GAA (0.54) MGAMGAASIMGAM2KMT2A
SCHEMBL24696141 0.86 GAA (0.48) MGAMGAASIMGAM2TDP1
SCHEMBL9134377 0.85 TDP1 (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL2779505 0.85 TDP1 (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL25311355 0.85 TDP1 (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL18797 0.85 TDP1 (0.50) MGAMGAASIMGAM2TDP1
Cyclohexane SCHEMBL28249403 0.85 TDP1 (0.50) MGAMGAASIMGAM2TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 WO disclosed