SCHEMBL29952885

SCHEMBL29952885

CCOC(=O)c1[nH]c2ccc(F)cc2c1C=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.62
KMT2A Q03164 6/20 0.54
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 9/20 0.53
HPGD P15428 8/20 0.53
MAPT P10636 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
MEN1 O00255 3/20 0.53
MAPK1 P28482 2/20 0.53
LMNA P02545 2/20 0.53
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TP53 P04637 2/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
USP2 O75604 2/20 0.47

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
SCHEMBL3275793 1.00 ALOX15 (0.62) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL29954264 0.90 ALOX15 (0.73) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL5399472 0.87 ALDH1A1 (0.67) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL15331909 0.86 ALOX15 (0.64) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL29951480 0.85 KMT2A (0.56) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL1503856 0.85 ALOX15 (0.81) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL29954955 0.85 ALOX15 (0.81) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL333829 0.85 ALOX15 (0.62) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL22346686 0.84 ALOX15 (0.59) ALOX15KMT2AKDM4EALDH1A1HPGD
SCHEMBL24375425 0.84 KMT2A (0.58) ALOX15KMT2AKDM4EALDH1A1HPGD

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 1 patent. 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