SCHEMBL2555014

SCHEMBL2555014

O=Cc1c(-c2ccccc2)nn(-c2cc(F)ccc2F)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 3/20 0.38
POLB P06746 1/20 0.37
ESR1 P03372 1/20 0.36
PTGER1 P34995 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
RIPK1 Q13546 1/20 0.34
HTT P42858 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.33
MAP2K4 P45985 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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
SCHEMBL2560165 0.92 LMNA (0.39) POLBESR1LMNARIPK1MEN1
SCHEMBL2559787 0.91 ESR1 (0.36) ESR1PTGER1RIPK1HTTKDM4E
SCHEMBL15330046 0.90 NPC1 (0.50) NPC1RAB9ANPSR1POLBPTGER1
SCHEMBL15331113 0.87 HPGD (0.39) NPC1RAB9ANPSR1POLBKMT2A
SCHEMBL15331603 0.86 TP53 (0.40) ESR1L3MBTL1MAPTRIPK1TP53
SCHEMBL2560532 0.85 NPC1 (0.39) NPC1RAB9ANPSR1POLBESR1
SCHEMBL2556623 0.85 POLB (0.41) NPSR1POLBLMNAKMT2ATP53
SCHEMBL15331264 0.84 PTGER1 (0.35) NPC1RAB9APTGER1HTTKMT2A
SCHEMBL2561079 0.82 NPC1 (0.40) NPC1RAB9APOLBL3MBTL1LMNA
SCHEMBL15330615 0.82 GAA (0.39) NPSR1GAARIPK1KMT2A

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