SCHEMBL15330218

SCHEMBL15330218

Cc1cc(C)c2[nH]c(-c3c(F)cccc3F)c(C=O)c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.40
MAPT P10636 2/20 0.39
PTGES O14684 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ERN1 O75460 1/20 0.33
PDE7A Q13946 1/20 0.33
DHODH Q02127 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 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
SCHEMBL2553148 0.90 PTGES (0.35) PTGESDHODHALDH1A1GSK3B
SCHEMBL2562003 0.86 ABCB1 (0.37) ABCB1MAPTSMN1; SMN2ERN1PDE7A
SCHEMBL29957349 0.85 ABCB1 (0.42) ABCB1MAPTSMN1; SMN2ERN1DHODH
SCHEMBL2562309 0.85 PDE7A (0.43) MAPTPDE7AALDH1A1GSK3BMEN1
SCHEMBL29951636 0.82 TNKS2 (0.44) ABCB1MAPTSMN1; SMN2ERN1TNKS2
SCHEMBL15329748 0.80 ERN1 (0.40) ABCB1MAPTSMN1; SMN2ERN1DHODH
SCHEMBL2560673 0.80 MEN1 (0.43) MAPTPTGESSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL29955733 0.80 ABCB1 (0.40) ABCB1MAPTPTGESSMN1; SMN2ALDH1A1
SCHEMBL15331062 0.80 ERN1 (0.33) MAPTPTGESSMN1; SMN2ERN1PDE7A
SCHEMBL29954645 0.80 TNKS2 (0.40) ABCB1MAPTSMN1; SMN2ERN1TNKS2

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 5 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