SCHEMBL2559372

SCHEMBL2559372

COC(=O)Nc1ccc(C=O)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 1/20 0.45
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ERN1 O75460 1/20 0.40
FAAH O00519 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
EPHX2 P34913 1/20 0.39
TP53 P04637 1/20 0.39
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL29956706 0.85 CA12 (0.48) ALDH1A1CA12CA9
SCHEMBL7055271 0.83 MEN1 (0.50) SMN1; SMN2KDM4EMAPTTSHRALDH1A1
SCHEMBL3931721 0.81 HPGD (0.57) SMN1; SMN2HPGDMAPTTSHRALDH1A1
SCHEMBL22279637 0.78 TNIK (0.52) SMN1; SMN2KDM4EHPGDMAPTTSHR
SCHEMBL3936393 0.78 KMT2A (0.58) SMN1; SMN2KDM4EMAPTALDH1A1MEN1
SCHEMBL4875564 0.78 MGLL (0.56) SMN1; SMN2MAPTTSHRALDH1A1TP53
SCHEMBL29952213 0.78 MGLL (0.56) SMN1; SMN2MAPTTSHRALDH1A1TP53
SCHEMBL17813317 0.77 SMN1; SMN2 (0.50) SMN1; SMN2KDM4EHPGDMAPTTSHR
SCHEMBL3931647 0.77 SMN1; SMN2 (0.50) SMN1; SMN2HPGDMAPTTSHRALDH1A1
SCHEMBL3926310 0.77 SMN1; SMN2 (0.54) SMN1; SMN2HPGDMAPTALDH1A1MEN1

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