SCHEMBL11043890

SCHEMBL11043890

[CH2]CCOC(=O)C(=C)CC=CC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.33
GABRR2 P28476 2/20 0.33
BLM P54132 2/20 0.33
GABRR3 A8MPY1 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
APEX1 P27695 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HCAR2 Q8TDS4 2/20 0.32

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
SCHEMBL916717 0.86 TSHR (0.38) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL10347220 0.84 HCAR2 (0.50) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL10456335 0.84 GABRR1 (0.41) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL17666862 0.83 HCAR2 (0.33) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL4587327 0.83 HCAR2 (0.35) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL7115770 0.81 GABRR1 (0.35) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL313840 0.81 HCAR2 (0.53) TSHRNPSR1TDP1HCAR2
Acrylic Acid SCHEMBL7214438 0.81 TSHR (0.43) GABRR1GABRR2BLMGABRR3LMNA
SCHEMBL7783202 0.80 HRH1 (0.32) HCAR2
SCHEMBL10981764 0.80

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-4478736-A FLYASH COUPLED WITH SILANE AND BONDED TO POLYACRYLAMIDE MONIER RESOURCES, INC. (US) 1984-10-23 US disclosed