SCHEMBL15329557

SCHEMBL15329557

O=Cc1ccc(Sc2nnc[nH]2)o1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 7/20 0.36
ALDH1A1 P00352 5/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 5/20 0.34
KDM4E B2RXH2 4/20 0.34
MAPK1 P28482 2/20 0.34
PKM P14618 1/20 0.34
NTSR1 P30989 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
POLB P06746 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2E1 P05181 1/20 0.33
CYP2B6 P20813 1/20 0.33
SMN1; SMN2 Q16637 4/20 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
SCHEMBL18920930 0.75 ALDH1A1 (0.50) ALDH1A1TSHRMAPTKDM4EMAPK1
SCHEMBL2106102 0.73 MYC (0.34) MYCALDH1A1TSHRMAPTKDM4E
SCHEMBL2107291 0.70 MYC (0.39) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2100202 0.68 MYC (0.67) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2106097 0.65 LMNA (0.50) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2105385 0.65 MYC (0.58) MYCALDH1A1MAPTKDM4EPOLB
SCHEMBL2106135 0.64 ALDH1A1 (0.41) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2107497 0.64 MYC (0.61) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2857240 0.64 MYC (0.48) MYCALDH1A1MAPTKDM4EMAPK1
SCHEMBL2106226 0.64 MYC (0.47) MYCALDH1A1MAPTKDM4EMAPK1

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 5 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