SCHEMBL29952437

SCHEMBL29952437

Cc1cc(C=O)nc(CO)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.39
LMNA P02545 2/20 0.32
SORD Q00796 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
AOX1 Q06278 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
POLB P06746 1/20 0.30
PKM P14618 1/20 0.30
MAPT P10636 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
SCHEMBL29957984 0.82 HTT (0.37) HTTLMNAKDM4EALDH1A1MAPT
SCHEMBL29955735 0.79 HTT (0.35) HTTLMNAKDM4EALDH1A1POLB
SCHEMBL2555142 0.79 HTT (0.71) HTTMEN1KMT2AKDM4EALDH1A1
SCHEMBL11981610 0.79 HTT (0.52) HTTHSD17B10LMNASORDMEN1
SCHEMBL29952038 0.78 HTT (0.34) HTTHSD17B10LMNAKDM4EALDH1A1
SCHEMBL29956524 0.74 ERN1 (0.35) HTTLMNAKDM4EALDH1A1HPGD
SCHEMBL29952455 0.73 ALDH1A1 (0.36) HSD17B10LMNAKMT2AKDM4EALDH1A1
SCHEMBL3089372 0.73 ALDH1A1 (0.36) HSD17B10LMNAKMT2AKDM4EALDH1A1
SCHEMBL6119931 0.69 NOS2 (0.46) HTTHSD17B10SORDMEN1KMT2A
SCHEMBL20851224 0.69 HTT (0.39) HTTHSD17B10LMNASORDMEN1

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