SCHEMBL26650804

SCHEMBL26650804

COC(=O)CCCCCCCCSCCO

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
LMNA P02545 3/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
RECQL P46063 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GBA1 P04062 1/20 0.38
EPHX2 P34913 2/20 0.37
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
HPGD P15428 1/20 0.36

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
SCHEMBL18771044 1.00 TSHR (0.52) TSHRLMNAALDH1A1KMT2ATDP1
SCHEMBL26650858 0.92 TSHR (0.52) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL7711991 0.92 TSHR (0.52) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL6380742 0.92 TSHR (0.56) TSHRLMNAALDH1A1KMT2ATDP1
SCHEMBL9105726 0.92 TSHR (0.61) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL11949551 0.90 TSHR (0.64) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL19071558 0.85 TSHR (0.52) TSHRLMNAALDH1A1KMT2AL3MBTL1
SCHEMBL10608277 0.85 TSHR (0.46) TSHRLMNAALDH1A1KMT2ARECQL
SCHEMBL15593806 0.85 TSHR (0.52) TSHRLMNAALDH1A1EPHX2
SCHEMBL29365230 0.85 TSHR (0.52) TSHRLMNAALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023215989-A1 SULFUR-CONTAINING LIPIDS NANOVATION THERAPEUTICS INC. (CA) 2023-11-16 WO disclosed
WO-2023215989-A1 SULFUR-CONTAINING LIPIDS NANOVATION THERAPEUTICS INC. (CA) 2023-11-16 WO disclosed