SCHEMBL24006240

SCHEMBL24006240

O=C(Nc1ccc(Nc2ccncc2)cc1)c1cc(Nc2ccnc3ccc(F)cc23)ccc1F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.58
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
POLB P06746 1/20 0.58
THRB P10828 1/20 0.58
MAPK1 P28482 1/20 0.58
MCL1 Q07820 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
DNMT1 P26358 4/20 0.55
DNMT3A Q9Y6K1 3/20 0.55
AURKA O14965 3/20 0.48
AURKB Q96GD4 3/20 0.48
DNMT3L Q9UJW3 1/20 0.47
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
TGFBR1 P36897 2/20 0.45
HTT P42858 2/20 0.44
GAK O14976 1/20 0.44

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
SCHEMBL24010936 0.94 USP2 (0.53) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL30290896 0.94 USP2 (0.53) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL25849591 0.94 USP2 (0.52) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL23999380 0.92 USP2 (0.61) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL24006004 0.90 USP2 (0.57) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL25820661 0.88 DNMT1 (0.53) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL23999381 0.88 USP2 (0.59) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL24006221 0.88 KMT2A (0.57) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL24006016 0.88 KMT2A (0.54) USP2MAPTKMT2AKDM4EALDH1A1
SCHEMBL23999735 0.87 DNMT1 (0.72) USP2MAPTKMT2AKDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023081854-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
WO-2023081845-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2023-05-11 WO disclosed
WO-2021226477-A1 AKT3 MODULATORS GEORGIAMUNE LLC (US) 2021-11-11 WO disclosed