SCHEMBL2561500

SCHEMBL2561500

COc1cccc(O)c1-c1nc(C=O)c[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ERN1 O75460 3/20 0.41
TLR2 O60603 1/20 0.41
TLR1 Q15399 1/20 0.41
TLR6 Q9Y2C9 1/20 0.41
EGFR P00533 1/20 0.40
PIM1 P11309 1/20 0.40
ALDH1A1 P00352 3/20 0.40
TP53 P04637 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 2/20 0.38

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
SCHEMBL2554101 0.90 TLR2 (0.39) MEN1KMT2AERN1TLR2TLR1
SCHEMBL2553826 0.84 LRRK2 (0.43) ERN1TLR2TLR1TLR6ALDH1A1
SCHEMBL15329585 0.81 GUSB (0.49) MEN1KMT2AERN1TLR2TLR1
SCHEMBL31429579 0.80 MEN1 (0.45) MEN1KMT2AEGFRPIM1ALDH1A1
SCHEMBL31429691 0.78 MEN1 (0.43) MEN1KMT2AEGFRPIM1ALDH1A1
SCHEMBL2559741 0.77 MAPT (0.54) MEN1KMT2AERN1ALDH1A1HPGD
SCHEMBL15332409 0.77 DCUN1D1 (0.48) ERN1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL2561480 0.77 FGFR1 (0.45) MEN1KMT2AERN1TLR2TLR1
SCHEMBL31429713 0.76 PDGFRB (0.44) MEN1KMT2AALDH1A1TP53HPGD
SCHEMBL2557542 0.76 CYP1A1 (0.48) MEN1KMT2AERN1EGFRALDH1A1

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