SCHEMBL4654971

SCHEMBL4654971

O=C(O)C(CCC(C(=O)O)S(=O)(=O)O)S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SRC P12931 2/20 0.34
PMP22 Q01453 1/20 0.33
FOLH1 Q04609 1/20 0.32
TET2 Q6N021 3/20 0.31
KDM4A O75164 2/20 0.31
KDM4C Q9H3R0 2/20 0.31
KDM2A Q9Y2K7 2/20 0.31
MMP2 P08253 1/20 0.31

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
SCHEMBL2451211 0.87 FOLH1 (0.48) FOLH1TET2KDM4AKDM4CKDM2A
SCHEMBL4140846 0.87 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL8746737 0.85 HDAC1 (0.54) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL1119747 0.85 GABRR1 (0.44) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL10086908 0.85 FOLH1 (0.40) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL169862 0.81 CA2 (0.48) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL28680816 0.81 CAMK2A (0.42) PMP22FOLH1TET2KDM4AKDM4C
SCHEMBL19714690 0.81 GPR84 (0.39) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL23754689 0.80 SRC (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL2813586 0.80 SRC (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994070-A1 SULFONATED AROMATIC POLYESTER POLYOL CMPOSITIONS Oxid, L.P. (US) 2008-11-26 EP disclosed
WO-2007100489-A1 SULFONATED AROMATIC POLYESTER POLYOL CMPOSITIONS OXID, L.P. (US) 2007-09-07 WO disclosed
US-20070208096-A1 Sulfonated aromatic polyester polyol compositions OXID L.P. 2007-09-06 US disclosed
EP-0717057-B1 Low surface energy sulfo-polyurethane or sulfo-polyurea compositions MINNESOTA MINING & MFG (US) 2001-06-20 EP disclosed
US-5679754-A INK RECEPTIVE COATINGS HAVING RELEASE PROPERTIES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-10-21 US disclosed
EP-0225800-B1 Hydrophilic polyurethane/polyurea sponge MINNESOTA MINING & MFG (US) 1997-05-14 EP disclosed
EP-0717057-A1 Low surface energy sulfo-polyurethane or sulfo-polyurea compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-06-19 EP disclosed
EP-0582674-A1 ABSORBENT, NON-SKINNED FOAM AND THE METHOD OF PREPARATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-02-16 EP disclosed
WO-1992019445-A1 ABSORBENT, NON-SKINNED FOAM AND THE METHOD OF PREPARATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-11-12 WO disclosed
US-5110843-A Immersion in water of substrate coated with isocyanate terminated prepolymer MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-05-05 US disclosed
US-4738992-A Hydrophilic polyurethane/polyurea sponge MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-04-19 US disclosed
EP-0225800-A1 Hydrophilic polyurethane/polyurea sponge MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-06-16 EP disclosed
US-4638017-A SULKO-GROUP CONTAINING POLYUREA AND POLYURETHANE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1987-01-20 US disclosed