SCHEMBL29958062

SCHEMBL29958062

CCCCNC(=O)COc1c(C=O)cccc1OC

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
KMT2A Q03164 3/20 0.50
SRC P12931 1/20 0.49
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 2/20 0.45
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.44
CTSD P07339 1/20 0.44
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL2556798 0.93 HSD17B10 (0.53) HSD17B10KMT2ASRCALDH1A1MEN1
SCHEMBL29952197 0.88 ALDH1A1 (0.56) HSD17B10KMT2ASRCALDH1A1POLB
SCHEMBL15330855 0.87 HPGD (0.55) HSD17B10KMT2ASRCPOLBMAPT
SCHEMBL2560755 0.84 HSD17B10 (0.49) HSD17B10KMT2ASRCALDH1A1POLB
SCHEMBL29950848 0.84 KMT2A (0.62) HSD17B10KMT2AALDH1A1MEN1MAPT
SCHEMBL15333167 0.83 ALDH1A1 (0.48) HSD17B10KMT2ASRCALDH1A1MEN1
SCHEMBL20150988 0.82 SRC (0.56) HSD17B10SRCALDH1A1POLBMAPT
SCHEMBL2555240 0.82 SRC (0.56) HSD17B10KMT2ASRCALDH1A1MEN1
SCHEMBL2556757 0.82 SRC (0.50) HSD17B10KMT2ASRCALDH1A1POLB
SCHEMBL2554954 0.82 SRC (0.50) HSD17B10KMT2ASRCALDH1A1POLB

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