SCHEMBL2552037

SCHEMBL2552037

COc1ccc(-c2ccccc2C=O)c(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.57
KDM4E B2RXH2 3/20 0.49
ERN1 O75460 2/20 0.49
AKR1C3 P42330 3/20 0.49
AKR1C2 P52895 3/20 0.49
PTPN11 Q06124 1/20 0.47
POLB P06746 4/20 0.47
TRIM24 O15164 1/20 0.46
TYR P14679 1/20 0.46
TRIM33 Q9UPN9 1/20 0.46
EIF4E P06730 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL3677398 0.83 ERN1 (0.56) KDM4EERN1TRIM24TYRTRIM33
SCHEMBL7267474 0.83 SMN1; SMN2 (0.79) SMN1; SMN2KDM4EAKR1C3AKR1C2POLB
SCHEMBL29853676 0.83 SMN1; SMN2 (0.79) SMN1; SMN2KDM4EAKR1C3AKR1C2POLB
SCHEMBL343958 0.82 TRIM24 (0.65) ERN1TRIM24TYRTRIM33MEN1
SCHEMBL2563725 0.81 EIF4E (0.47) KDM4EERN1POLBEIF4EALDH1A1
SCHEMBL6536172 0.81 SMN1; SMN2 (0.62) SMN1; SMN2KDM4EAKR1C3AKR1C2PTPN11
SCHEMBL548189 0.80 TRIM24 (0.61) SMN1; SMN2KDM4EERN1AKR1C3AKR1C2
SCHEMBL29955976 0.80 TRIM24 (0.61) SMN1; SMN2KDM4EERN1AKR1C3AKR1C2
SCHEMBL28036196 0.79 SMN1; SMN2 (0.60) SMN1; SMN2KDM4EAKR1C3AKR1C2PTPN11
SCHEMBL7582880 0.79 ALDH1A1 (0.62) ERN1TRIM24TYRTRIM33ALDH1A1

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