SCHEMBL6882428

SCHEMBL6882428

CC(CCO)CC(O)C(O)C(O)CO

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
TRPA1 O75762 1/20 0.38
TSHR P16473 1/20 0.37
KDM4E B2RXH2 2/20 0.37
THRB P10828 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
PDE4A P27815 1/20 0.32
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 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
SCHEMBL6706841 0.84 TRPA1 (0.37) LMNAL3MBTL1TDP1TRPA1TSHR
SCHEMBL6839625 0.84 TSHR (0.41) LMNATRPA1TSHRALDH1A1ALOX15
SCHEMBL1904032 0.83 TRPA1 (0.45) LMNATDP1TRPA1TSHRTHRB
Adonitol SCHEMBL27590136 0.78 LMNA (0.50) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL19327340 0.76 TSHR (0.46) LMNATDP1TRPA1TSHRTHRB
SCHEMBL15484287 0.75 LMNA (0.53) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL16745483 0.75 LMNA (0.53) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL16745482 0.75 LMNA (0.53) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL16745478 0.75 LMNA (0.53) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL16745484 0.75 LMNA (0.53) LMNAL3MBTL1TDP1TSHRKDM4E

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
EP-1426391-A1 Aqueous polyurethane dispersions and their use for preparation of coatings that are permeable to water vapor UCB, S.A. (BE) 2004-06-09 EP disclosed