SCHEMBL2557528

SCHEMBL2557528

COc1ccc(OC)c(-c2nc(C=O)c[nH]2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.44
HSD17B10 Q99714 2/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 6/20 0.43
NR1I2 O75469 2/20 0.41
MAPT P10636 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
RECQL P46063 2/20 0.39
MAPK1 P28482 1/20 0.39
ADORA3 P0DMS8 2/20 0.39
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 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
SCHEMBL2554665 0.89 ALDH1A1 (0.46) KDM4EHTTALDH1A1MAPTCYP1A2
SCHEMBL2556390 0.86 ERN1 (0.47) SMN1; SMN2ALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL2550228 0.86 GRK6 (0.44) KDM4EALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL2557565 0.85 GUSB (0.48) KDM4EHTTSMN1; SMN2ALDH1A1MAPT
SCHEMBL15332234 0.85 AMY1A (0.49) HTTSMN1; SMN2ALDH1A1MAPTPOLB
SCHEMBL15330573 0.83 TRIM24 (0.49) KDM4ESMN1; SMN2ALDH1A1MAPTCYP1A2
SCHEMBL15330736 0.83 ERN1 (0.40) SMN1; SMN2ALDH1A1POLBHDAC4HDAC8
SCHEMBL2556126 0.82 AMY1A (0.51) KDM4EALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL15332409 0.81 DCUN1D1 (0.48) HSD17B10SMN1; SMN2ALDH1A1L3MBTL1HPGD
SCHEMBL2556342 0.79 GSTP1 (0.46) KDM4EALDH1A1MAPTCYP1A2CYP2C19

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