SCHEMBL2559955

SCHEMBL2559955

COCc1nn(-c2cc(C)ccc2C)c(Cl)c1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.38
MCHR1 Q99705 1/20 0.38
CNR2 P34972 1/20 0.36
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
GAA P10253 2/20 0.33
OPRM1 P35372 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
ALDH1A1 P00352 6/20 0.32
LMNA P02545 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TSHR P16473 2/20 0.31
HTT P42858 2/20 0.31
USP2 O75604 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL2554043 0.90 NPBWR1 (0.38) NPBWR1CNR2CDK4CCND1GAA
SCHEMBL2555855 0.86 CNR2 (0.40) NPBWR1MCHR1CNR2CDK4CCND1
SCHEMBL15331141 0.85 PDE4A (0.39) NPBWR1GAAMAPTHSD17B10PDE4A
SCHEMBL15332085 0.84 CNR2 (0.41) NPBWR1MCHR1CNR2CDK4CCND1
SCHEMBL2560783 0.82 GAA (0.44) NPBWR1MCHR1GAAMAPTALDH1A1
SCHEMBL2559829 0.81 NPBWR1 (0.45) NPBWR1MCHR1GAAMAPTALDH1A1
SCHEMBL15329464 0.81 MAPT (0.41) GAAMAPTALDH1A1LMNASMN1; SMN2
SCHEMBL2552686 0.80 OPRM1 (0.43) NPBWR1MCHR1CNR2CDK4CCND1
SCHEMBL2562172 0.80 GAA (0.35) NPBWR1MCHR1CNR2GAAMAPT
SCHEMBL2557712 0.80 ALDH1A1 (0.40) GAAMAPTALDH1A1LMNASMN1; SMN2

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