SCHEMBL2562091

SCHEMBL2562091

Cc1ccc(C)c(NC(=O)COc2ccc(C=O)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
POLB P06746 5/20 0.55
KDM4E B2RXH2 1/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
MAPT P10636 3/20 0.53
NLRP3 Q96P20 1/20 0.53
HTT P42858 2/20 0.53
LMNA P02545 2/20 0.53
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
BLM P54132 1/20 0.49

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
SCHEMBL2562077 0.90 KMT2A (0.67) ALDH1A1POLBKDM4EKMT2AMEN1
SCHEMBL2556302 0.86 POLB (0.61) ALDH1A1POLBKMT2AMEN1MAPT
SCHEMBL2556482 0.84 ALDH1A1 (0.69) ALDH1A1POLBKDM4EKMT2AMEN1
SCHEMBL2552959 0.82 MAPT (0.59) ALDH1A1POLBKDM4EKMT2AMEN1
SCHEMBL2558204 0.81 KMT2A (0.72) POLBKMT2AMEN1MAPTHTT
SCHEMBL2559044 0.81 MAPT (0.63) ALDH1A1POLBKDM4EKMT2AMEN1
SCHEMBL2556932 0.80 ALDH1A1 (0.62) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL2555766 0.80 MAPK1 (0.74) ALDH1A1POLBKMT2AMEN1MAPT
SCHEMBL2554793 0.78 NPC1 (0.65) ALDH1A1POLBKMT2AMEN1MAPT
SCHEMBL2557813 0.77 POLB (0.61) ALDH1A1POLBKMT2AMEN1MAPT

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