SCHEMBL5329190

SCHEMBL5329190

CC(=O)OCOP(O)(O)=S

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LPAR3 Q9UBY5 9/20 0.35
LPAR2 Q9HBW0 8/20 0.35
ENPP2 Q13822 6/20 0.33
LPAR1 Q92633 4/20 0.33
LPAR6 P43657 3/20 0.33
LPAR4 Q99677 3/20 0.33
LPAR5 Q9H1C0 3/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRM3 P20309 1/20 0.33
TBXA2R P21731 1/20 0.33
CHRNB4 P30926 1/20 0.33

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
SCHEMBL5167134 0.78 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10LPAR3LPAR2
SCHEMBL10378936 0.78 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL14019302 0.76 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL7620877 0.75 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL13301617 0.73 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL16075571 0.73 PLA2G2A (0.37) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL322669 0.73
SCHEMBL19448939 0.70 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10PGRCHRM2
SCHEMBL16333390 0.69 ALDH1A1 (0.38) ALDH1A1LMNAHSD17B10TSHRGLA
SCHEMBL14017058 0.68 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10PGRCHRM2

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-2007149554-A2 METHODS FOR RESTORING NEURAL FUNCTION THE JOHNS HOPKINS UNIVERSITY (US) 2007-12-27 WO claimed
WO-2007149554-A2 METHODS FOR RESTORING NEURAL FUNCTION THE JOHNS HOPKINS UNIVERSITY (US) 2007-12-27 WO disclosed