SCHEMBL8971230

SCHEMBL8971230

CCCCCCCCCC(C)(OO)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
ALOX15 P16050 1/20 0.46
CNR2 P34972 5/20 0.41
CNR1 P21554 4/20 0.41
SIGMAR1 Q99720 2/20 0.38
GAA P10253 1/20 0.38
SCN5A Q14524 3/20 0.38
SCN9A Q15858 3/20 0.38
EBP Q15125 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
CETP P11597 1/20 0.36

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
SCHEMBL1581689 1.00 ALDH1A1 (0.46) ALDH1A1ALOX15CNR2CNR1SIGMAR1
SCHEMBL27998616 0.98 ALDH1A1 (0.47) ALDH1A1ALOX15CNR2CNR1SIGMAR1
SCHEMBL1581716 0.86 MAPK1 (0.42) CNR2CNR1SIGMAR1GAASCN5A
SCHEMBL28944297 0.86 CNR2 (0.40) CNR2CNR1SIGMAR1GAASCN5A
SCHEMBL1581356 0.86 MAPK1 (0.42) CNR2CNR1SIGMAR1GAASCN5A
Hexane SCHEMBL8712556 0.83 ALDH1A1 (0.46) ALDH1A1ALOX15TSHRCES2CES1
SCHEMBL5180283 0.82 MAPK1 (0.38) ALDH1A1ALOX15CNR2CNR1SIGMAR1
Hydrochloric Acid SCHEMBL10596870 0.81 CNR2 (0.37) CNR2CNR1SIGMAR1EBPMEN1
SCHEMBL9242864 0.81 ALDH1A1 (0.42) ALDH1A1ALOX15CNR2CNR1SIGMAR1
SCHEMBL8660644 0.80 CETP (0.38) CNR2CNR1CETP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516885-B1 Styrene/acrylic-type polymers for use as surface sizing agents CYTEC TECH CORP (US) 1996-03-20 EP disclosed
EP-0516885-A1 Styrene/acrylic-type polymers for use as surface sizing agents CYTEC TECHNOLOGY CORP. (US) 1992-12-09 EP disclosed
US-5139614-A Paper sizing comprising a neutralized polymer of styrene or a derivative and methacrylic or acrylic acid; impervious to inks AMERICAN CYANAMID COMPANY (US) 1992-08-18 US disclosed
US-5138004-A For rendering paper to resist penetration of ink or an aqueous liquid KEMIRA OYJ (FI) 1992-08-11 US disclosed
US-5122568-A Solution polymerization in an alcohol/water at reflux temperature using a free-radical catalyst added portion-wise; concurrent neutralization and desolventizing AMERICAN CYANAMID COMPANY (US) 1992-06-16 US disclosed