SCHEMBL2561067

SCHEMBL2561067

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

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.35
RIPK1 Q13546 1/20 0.35
SCN9A Q15858 1/20 0.34
MAPK11 Q15759 1/20 0.34
MAPK14 Q16539 1/20 0.34
P2RX7 Q99572 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
NFE2L2 Q16236 2/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
HTR7 P34969 1/20 0.30

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
SCHEMBL15332118 0.88 CDK4 (0.40) SCN9AMAPK11MAPK14L3MBTL1CDK4
SCHEMBL2560689 0.88 L3MBTL1 (0.39) MAPK11MAPK14P2RX7L3MBTL1
SCHEMBL2561348 0.85 MARS1 (0.36) SCN9AMAPK11MAPK14P2RX7
SCHEMBL2560165 0.83 LMNA (0.39) ESR1RIPK1MAPK14
SCHEMBL15330119 0.82 KMT2A (0.42) MAPK11MAPK14L3MBTL1NFE2L2
SCHEMBL2555014 0.81 NPC1 (0.39) ESR1RIPK1L3MBTL1
SCHEMBL15331603 0.80 TP53 (0.40) ESR1RIPK1MAPK11MAPK14L3MBTL1
SCHEMBL2559787 0.80 ESR1 (0.36) ESR1RIPK1SCN9ANFE2L2
SCHEMBL15332400 0.78 MAPT (0.43)
SCHEMBL15331270 0.78 MAPT (0.34)

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