SCHEMBL9512804

SCHEMBL9512804

CC(CN1CCOCC1)C(=O)C(=O)C(C)CN1CCOCC1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.72
LMNA P02545 2/20 0.57
USP2 O75604 1/20 0.54
ANPEP P15144 1/20 0.47
KDM4E B2RXH2 4/20 0.45
HSD17B10 Q99714 2/20 0.45
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL500091 0.86 ALDH1A1 (0.96) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL14276784 0.86 ALDH1A1 (0.70) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL27899777 0.84 ALDH1A1 (0.93) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL7979632 0.84 ALDH1A1 (0.68) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL7979638 0.84 ALDH1A1 (0.68) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL13895441 0.82 ALDH1A1 (0.66) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL1817377 0.82 ALDH1A1 (0.66) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL10153768 0.81 ALDH1A1 (0.64) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL1816293 0.81 ALDH1A1 (0.64) ALDH1A1LMNAUSP2ANPEPKDM4E
SCHEMBL11668488 0.81 ALDH1A1 (0.64) ALDH1A1LMNAUSP2ANPEPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0260877-B1 Photosensitizers and polymerizable compositions MINNESOTA MINING & MFG (US) 1993-11-03 EP disclosed
US-4792506-A FREE RADICAL POLYMERIZATION OF VINYL MONOMERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-12-20 US disclosed
EP-0260877-A2 Photosensitizers and polymerizable compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-03-23 EP disclosed