SCHEMBL7595348

SCHEMBL7595348

C=CC(=O)OC(C)C(CCCCCCCCCCCCCC)C(C)(C)N

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
FAAH O00519 5/20 0.35
ABCB1 P08183 1/20 0.35
LMNA P02545 2/20 0.34
CA2 P00918 1/20 0.34
THRB P10828 2/20 0.34
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
THRA P10827 1/20 0.34
ACE2 Q9BYF1 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
ZDHHC7 Q9NXF8 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
Bromide SCHEMBL28633924 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Bromide SCHEMBL28360606 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Bromide SCHEMBL28360481 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Hydrochloric Acid SCHEMBL28914307 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Bromide SCHEMBL28635423 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Hydrochloric Acid SCHEMBL28597334 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Hydrochloric Acid SCHEMBL28576640 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Bromide SCHEMBL28633534 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Hydrochloric Acid SCHEMBL28563696 0.99 TSHR (0.38) TSHRHPGDFAAHABCB1LMNA
Hydrochloric Acid SCHEMBL28565776 0.86 TSHR (0.37) TSHRHPGDFAAHABCB1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1252206-A2 WATER SOLUBLE SALINE AQUEOUS DISPERSIONS OF COPOLYMERS BASED ON CATIONIC MONOMERS, METHOD FOR MAKING SAME AND USES THEREOF Atofina (FR) 2002-10-30 EP disclosed
EP-1252208-A2 SALINE AQUEOUS DISPERSIONS OF WATER SOLUBLE (CO)POLYMERS BASED ON CATIONIC MONOMERS, METHOD FOR MAKING SAME AND USES THEREOF Atofina (FR) 2002-10-30 EP disclosed
WO-2001055224-A2 WATER SOLUBLE SALINE AQUEOUS DISPERSIONS OF COPOLYMERS BASED ON CATIONIC MONOMERS, METHOD FOR MAKING SAME AND USES THEREOF ATOFINA (FR) 2001-08-02 WO disclosed
WO-2001055226-A2 SALINE AQUEOUS DISPERSIONS OF WATER SOLUBLE (CO)POLYMERS BASED ON CATIONIC MONOMERS, METHOD FOR MAKING SAME AND USES THEREOF ATOFINA (FR) 2001-08-02 WO disclosed