SCHEMBL2558730

SCHEMBL2558730

Cc1cc(C)cc(-c2nn(C)c(Br)c2C=O)c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL15332946 0.85 TDP2 (0.40) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL15331430 0.84 SMN1; SMN2 (0.41) SMN1; SMN2
SCHEMBL2554367 0.83 CYP1A2 (0.33) CYP1A2CYP2C9
SCHEMBL2553160 0.83 SMN1; SMN2 (0.38) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2557824 0.81 CYP1A2 (0.38) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL17295098 0.81 ERN1 (0.35) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL17290359 0.81 ERN1 (0.35) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL2557149 0.80 RIPK2 (0.35)
SCHEMBL15331614 0.80 CYP1B1 (0.37) SMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL15329462 0.79 PTGS2 (0.45) SMN1; SMN2CYP1A2CYP2C9CYP2C19

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