SCHEMBL2559956

SCHEMBL2559956

O=Cc1ccc(OCc2csc(C(=O)O)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.49
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 4/20 0.49
RAB9A P51151 8/20 0.47
NPC1 O15118 7/20 0.47
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 5/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
MAPK1 P28482 2/20 0.39

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
SCHEMBL2555519 0.85 MAOA (0.52) SMN1; SMN2RAB9ANPC1MAPTLMNA
SCHEMBL3554869 0.82 RAB9A (0.52) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL2556049 0.80 MRGPRX4 (0.45) SMN1; SMN2RAB9ANPC1MAPTPOLB
SCHEMBL3561666 0.80 NPC1 (0.57) SMN1; SMN2RAB9ANPC1MAPTLMNA
SCHEMBL14530530 0.79 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL4036753 0.77 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL9258868 0.73 MAPT (0.58) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL9263735 0.73 NPC1 (0.54) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL8800604 0.71 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL9264234 0.70 ALOX5 (0.50) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1

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