SCHEMBL2562812

SCHEMBL2562812

O=Cc1c(-c2c(F)cccc2F)nn(-c2cccc(F)c2)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.37
MAPT P10636 1/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
HTT P42858 1/20 0.36
TP53 P04637 1/20 0.35
MAPK14 Q16539 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
KMT2A Q03164 3/20 0.33
ADORA3 P0DMS8 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
NFE2L2 Q16236 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
SCHEMBL2558565 0.88 RAB9A (0.43) MAPTHTTTP53NPC1RAB9A
SCHEMBL15331481 0.88 IDO1 (0.43) ESR1MAPTIDO1TDO2HTT
SCHEMBL15329560 0.87 MAPT (0.40) MAPTTP53NPC1RAB9AKMT2A
SCHEMBL2554791 0.86 IDO1 (0.39) ESR1MAPTIDO1TDO2HTT
SCHEMBL29956177 0.86 ESR1 (0.38) ESR1IDO1TDO2HTTFAAH
SCHEMBL2559114 0.85 ESR1 (0.40) ESR1MAPTIDO1TDO2HTT
SCHEMBL2555130 0.85 ESR1 (0.38) ESR1MAPTIDO1TDO2HTT
SCHEMBL15329613 0.85 POLB (0.43) ESR1IDO1TDO2MAPK14KMT2A
SCHEMBL15329733 0.85 POLB (0.40) ESR1IDO1TDO2HTTMAPK14
SCHEMBL2557255 0.85 ESR1 (0.37) ESR1IDO1TDO2TP53MAPK14

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