SCHEMBL5875252

SCHEMBL5875252

O=C(CCCCC(=O)O[n+]1ccccc1)O[n+]1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.32
LMNA P02545 4/20 0.32
TDP1 Q9NUW8 2/20 0.32
PAM P19021 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MAPT P10636 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
NFKB1 P19838 1/20 0.31
PMP22 Q01453 1/20 0.31
DGKA P23743 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
SCHEMBL5875417 0.98 LMNA (0.35) TSHRLMNATDP1PAML3MBTL1
SCHEMBL5875270 0.95 TSHR (0.37) TSHR
SCHEMBL5874405 0.91 TSHR (0.32) TSHRTDP1
SCHEMBL5875055 0.90 PAM (0.46) TSHRLMNATDP1PAMDGKA
SCHEMBL5227646 0.90 L3MBTL1 (0.34) TSHRLMNATDP1PAML3MBTL1
SCHEMBL5875224 0.89 PAM (0.49) TSHRLMNATDP1PAMMAPT
SCHEMBL11063539 0.89 PAM (0.49) TSHRLMNATDP1PAMMAPT
SCHEMBL10556965 0.89 PAM (0.49) TSHRLMNATDP1PAMMAPT
SCHEMBL5875398 0.89 PAM (0.49) TSHRLMNATDP1PAMMAPT
SCHEMBL5874365 0.89 PAM (0.49) TSHRLMNATDP1PAMMAPT

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
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed