SCHEMBL2560293

SCHEMBL2560293

Cc1nc(-c2cccc(F)c2F)ccc1B(O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
HSD11B1 P28845 1/20 0.35
WDR5 P61964 1/20 0.35
HSD17B14 Q9BPX1 2/20 0.33
PDE10A Q9Y233 1/20 0.33
TRPV3 Q8NET8 1/20 0.33
TGFBR1 P36897 1/20 0.33
IDO1 P14902 1/20 0.33
FAAH O00519 1/20 0.33
SLC9A1 P19634 1/20 0.33
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
CNR2 P34972 1/20 0.33

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
SCHEMBL2562795 0.81 HSD11B1 (0.38) CTSAHSD11B1WDR5HSD17B14PDE10A
SCHEMBL4427250 0.76 ALDH1A1 (0.63) CTSAKDM4EALDH1A1HPGDHSD17B14
SCHEMBL21352397 0.75 JAK2 (0.36) CTSAKDM4EHSD11B1WDR5SLC9A1
SCHEMBL29954944 0.75 NPC1 (0.33)
SCHEMBL2558643 0.74 KMO (0.46) HSD11B1CNR2
SCHEMBL10268446 0.73 CCR1 (0.56) CTSAHSD11B1TGFBR1
SCHEMBL21352418 0.73 JAK2 (0.35) CTSAHSD11B1HSD17B14PDE10A
SCHEMBL21352416 0.73 IDO1 (0.40) CTSAHSD11B1WDR5IDO1CNR2
SCHEMBL2561639 0.71 CNR2 (0.37) CTSAKDM4EHSD11B1WDR5SLC9A1
SCHEMBL4422146 0.71 MDM2 (0.48) KDM4EALDH1A1HPGDTGFBR1

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