SCHEMBL2559638

SCHEMBL2559638

O=CC1CCCN(CC(=O)NCc2cccs2)C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
LMNA P02545 2/20 0.53
HPGD P15428 5/20 0.51
KMT2A Q03164 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 3/20 0.51
TDP1 Q9NUW8 1/20 0.51
HSD17B10 Q99714 1/20 0.50
GALR3 O60755 1/20 0.50
POLB P06746 3/20 0.49
MAPT P10636 1/20 0.49
USP2 O75604 1/20 0.48
GFER P55789 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 1/20 0.47

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
SCHEMBL2561822 0.89 ADAM17 (0.46) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL2553761 0.86 ALDH1A1 (0.62) ALDH1A1LMNAHPGDKMT2ASMN1; SMN2
SCHEMBL29952957 0.81 HTT (0.58) ALDH1A1LMNAHPGDKMT2ASMN1; SMN2
SCHEMBL20578475 0.81 ALDH1A1 (0.42) ALDH1A1LMNAHPGDKMT2ASMN1; SMN2
SCHEMBL2562910 0.80 ALDH1A1 (0.54) ALDH1A1HPGDKMT2AMEN1KDM4E
SCHEMBL15333265 0.78 NPC1 (0.45) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL15330996 0.77 KMT2A (0.55) ALDH1A1LMNAHPGDKMT2AMEN1
SCHEMBL2558292 0.75 ALDH1A1 (0.52) ALDH1A1LMNAHPGDKMT2ASMN1; SMN2
SCHEMBL27711029 0.74 HPGD (0.43) ALDH1A1HPGDKMT2AMEN1KDM4E
SCHEMBL15330891 0.74 ALDH1A1 (0.63) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1

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 6 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
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