SCHEMBL2561250

SCHEMBL2561250

C=C(Cl)COc1ccc(C=O)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.65
ALDH1A1 P00352 12/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
TSHR P16473 1/20 0.60
POLB P06746 1/20 0.60
KDM4E B2RXH2 1/20 0.59
MAPT P10636 4/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 2/20 0.53
HTT P42858 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HPGD P15428 3/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
AOX1 Q06278 1/20 0.51
TRIM24 O15164 1/20 0.51

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
SCHEMBL15332160 0.94 ALDH1A1 (0.60) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL2557026 0.87 ALDH1A1 (0.68) FDPSALDH1A1SMN1; SMN2POLBKDM4E
SCHEMBL5789086 0.87 ALDH1A1 (0.67) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL15330280 0.85 FDPS (0.65) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL15678982 0.84 ALDH1A1 (0.56) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL29956255 0.83 ALDH1A1 (0.47) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL6536289 0.82 POLB (0.74) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL18095848 0.82 ALDH1A1 (0.72) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL2557700 0.82 ALDH1A1 (0.55) FDPSALDH1A1SMN1; SMN2TSHRPOLB
SCHEMBL2284391 0.81 ALDH1A1 (0.74) FDPSALDH1A1SMN1; SMN2TSHRPOLB

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 6 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
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