SCHEMBL8422894

SCHEMBL8422894

CCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CCl

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.69
RAD52 P43351 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
DGKA P23743 1/20 0.57
FAAH O00519 1/20 0.56
HTR2C P28335 1/20 0.55
EPHX1 P07099 1/20 0.53
ACHE P22303 6/20 0.52
TSHR P16473 2/20 0.52
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
HCAR2 Q8TDS4 1/20 0.48

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
SCHEMBL2232831 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL1035473 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL6939502 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL1038102 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL9717821 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL2434790 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL11694516 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL1033167 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL2817365 1.00 NAAA (0.69) NAAARAD52NPSR1DGKAFAAH
SCHEMBL1037338 0.98 NAAA (0.65) NAAARAD52NPSR1DGKAFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114058173-A Process and composition for producing flexible polyurethane foams 赢创运营有限公司 2022-02-18 CN claimed
CN-114058173-A Process and composition for producing flexible polyurethane foams 赢创运营有限公司 2022-02-18 CN disclosed
EP-0765306-B1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN CO (US) 1999-10-20 EP disclosed
EP-0765306-A1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN COMPANY (US) 1997-04-02 EP disclosed
US-5616782-A HEATING ALKYL CHLOROESTER WITH MOLAR EXCESS OF AQUEOUS SULFITE IN PRESENCE OF SULFITATION CATALYST STEPAN COMPANY (US) 1997-04-01 US disclosed
WO-1995034532-A1 ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME STEPAN COMPANY (US) 1995-12-21 WO disclosed