SCHEMBL2561808

SCHEMBL2561808

Cc1nn(CC(N)=O)c(C)c1C=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
GAA P10253 3/20 0.45
ALDH1A1 P00352 2/20 0.43
ATM Q13315 1/20 0.34
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
APAF1 O14727 2/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32

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
SCHEMBL2562153 0.83 SMN1; SMN2 (0.36) LMNAGAAALDH1A1MAPTNPC1
SCHEMBL4744968 0.78 ALDH1A1 (0.69) LMNAGAAALDH1A1MAPTPOLB
SCHEMBL2559448 0.78 ALDH1A1 (0.39) LMNAGAAALDH1A1ATMMAPT
SCHEMBL15332705 0.78 ALDH1A1 (0.39) LMNAGAAALDH1A1ATMMAPT
SCHEMBL2553217 0.78 APAF1 (0.49) LMNAGAAALDH1A1MAPTPOLB
SCHEMBL15332321 0.78 GAA (0.41) LMNAGAAALDH1A1ATMPOLB
SCHEMBL2554897 0.76 HTT (0.59) GAAALDH1A1ATMMAPTPOLB
SCHEMBL3322655 0.76 SMN1; SMN2 (0.42) LMNAATMMAPTHTTNPC1
SCHEMBL2556249 0.75 TSHR (0.42) LMNAGAAALDH1A1ATMMAPT
SCHEMBL2560601 0.75 KMO (0.43) GAAALDH1A1ATMMAPTAPAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed