SCHEMBL26063007

SCHEMBL26063007

CC(=O)CCCC(=O)NCCCOCCCCOCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 2/20 0.38
TLR2 O60603 2/20 0.36
FAAH O00519 1/20 0.36
NAMPT P43490 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
RECQL P46063 1/20 0.35
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL25892891 0.89 TSHR (0.46) TSHRSMN1; SMN2HPGDTLR2FAAH
SCHEMBL23729612 0.88 FAAH (0.43) TSHRSMN1; SMN2HPGDTLR2FAAH
SCHEMBL26708614 0.88 FAAH (0.43) TSHRSMN1; SMN2HPGDTLR2FAAH
SCHEMBL25029533 0.87 TSHR (0.51) TSHRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL2625059 0.84 TSHR (0.49) TSHRSMN1; SMN2HPGDTLR2FAAH
SCHEMBL25029949 0.83 SMN1; SMN2 (0.56) TSHRSMN1; SMN2HPGDKMT2AHSD17B10
SCHEMBL12214864 0.81 TSHR (0.49) TSHRSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL26724992 0.81 PAOX (0.40) TSHRTLR2ALDH1A1
SCHEMBL18959180 0.80 TSHR (0.54) TSHRSMN1; SMN2FAAHCNR1RECQL
SCHEMBL16071577 0.80 TSHR (0.54) TSHRSMN1; SMN2HPGDFAAHMEN1

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
WO-2023161874-A1 CYTOTOXICITY TARGETING CHIMERAS FOR C-C CHEMOKINE RECEPTOR 2-EXPRESSING CELLS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-08-31 WO disclosed