SCHEMBL8169202

SCHEMBL8169202

C=C(C)C(=O)OCCCCCCCCCCCCCCC.C=C(C)C(=O)OCCCCCCCCCCCCCCC(CCCCC)CCCCCCCCCCCCCCCC

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.80
THRB P10828 1/20 0.47
NAAA Q02083 1/20 0.46
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HCAR2 Q8TDS4 2/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41
CES2 O00748 1/20 0.41
FAAH O00519 2/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39

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
SCHEMBL6684134 1.00 TSHR (0.80) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL651325 0.94 TSHR (0.75) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL7597256 0.90 TSHR (0.64) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL11775454 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL6655183 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL1977194 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL22579031 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL15200 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL14995 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL21853811 0.89 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1

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
EP-1015532-A2 METHOD FOR IMPROVING LOW-TEMPERATURE FLUIDITY OF LUBRICATING OILS USING HIGH- AND LOW-MOLECULAR WEIGHT POLYMER ADDITIVE MIXTURES Röhm RohMax Holding GmbH (DE) 2000-07-05 EP disclosed
WO-1999010454-A2 MIXTURES OF HIGH- AND LOW-MOLECULAR WEIGHT POYMERIC ADDITIVES FOR THE IMPROVEMENT OF THE LOW-TEMPERATURE FLUIDITY OF LUBRICATING OILS Röhm RohMax Holding GmbH (DE) 1999-03-04 WO disclosed