SCHEMBL2561052

SCHEMBL2561052

O=Cc1c(-c2ccccc2F)[nH]c2c(F)c(Cl)ccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 1/20 0.34
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
HCRTR1 O43613 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
ALOX5 P09917 1/20 0.32
APEX1 P27695 1/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP2C9 P11712 2/20 0.30
PTGES O14684 1/20 0.30
CYP1A2 P05177 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
SCHEMBL15331545 0.88 TNKS2 (0.36) GPR17TNKSTNKS2KMT2AMAPT
SCHEMBL2560269 0.87 TNKS (0.36) TNKSTNKS2ALOX5APEX1CNR1
SCHEMBL15331433 0.85 CDK5 (0.42) KMT2AKDM4ENPC1HCRTR1MAPT
SCHEMBL2556373 0.84 NOS2 (0.35) TNKS2KMT2AKDM4ENPC1HCRTR1
SCHEMBL15330874 0.81 CNR1 (0.40) TNKSTNKS2KMT2AMAPTALOX5
SCHEMBL15331395 0.80 AR (0.35) TNKSTNKS2KMT2AKDM4ENPC1
SCHEMBL15330473 0.80 KMT2A (0.41) KMT2AKDM4ENPC1HCRTR1MAPT
SCHEMBL2561523 0.79 ERN1 (0.33) TNKSTNKS2
SCHEMBL2561703 0.78 PDE7A (0.40) KMT2AKDM4ENPC1HCRTR1MAPT
SCHEMBL15332197 0.78 TNKS (0.42) TNKSTNKS2KDM4ENPC1MAPT

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