SCHEMBL6254971

SCHEMBL6254971

CC1(C)CCCN(C(CCCCCCCC(=O)O)(C(=O)O)N2CCCC(C)(C)C2(C)C)C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 5/20 0.33
LMNA P02545 1/20 0.33
NFKB1 P19838 1/20 0.33
PMP22 Q01453 1/20 0.33
TBXAS1 P24557 2/20 0.33
SCD O00767 1/20 0.33
GPR84 Q9NQS5 7/20 0.33
PPARG P37231 7/20 0.33
PPARD Q03181 7/20 0.33
PPARA Q07869 7/20 0.33
HDAC11 Q96DB2 5/20 0.33
PTPN1 P18031 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TLR2 O60603 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
FABP4 P15090 2/20 0.33
SLC22A6 Q4U2R8 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
SCHEMBL6253569 0.77 ITGB3 (0.33) TSHRLMNANFKB1PMP22TBXAS1
Sebacic Acid SCHEMBL27841725 0.77 CYP1A2 (0.42) CYP1A2MAPK1SMN1; SMN2TSHRLMNA
Sebacic Acid SCHEMBL29499850 0.76 CYP1A2 (0.41) CYP1A2MAPK1SMN1; SMN2TSHRLMNA
SCHEMBL561947 0.75 TSHR (0.36) TSHRLMNANFKB1PMP22TBXAS1
Stearic Acid SCHEMBL27904975 0.72 GPR84 (0.52) CYP1A2TSHRLMNASCDGPR84
Decanoic Acid SCHEMBL28177361 0.72 GPR84 (0.52) CYP1A2TSHRLMNASCDGPR84
SCHEMBL29449502 0.72 ALOX5 (0.39) TSHRSCDGPR84PPARGPPARD
SCHEMBL9054086 0.71 TDP1 (0.33) TSHRLMNANFKB1PMP22TBXAS1
SCHEMBL1908068 0.71 CYP1A2 (0.46) CYP1A2MAPK1SMN1; SMN2TSHRLMNA
SCHEMBL869253 0.70 TSHR (0.36) TSHRLMNANFKB1PMP22TBXAS1

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-1070102-B1 ANTIFOULANT COMPOSITIONS AND METHODS OF TREATING WOOD BURLINGTON BIO MED & SCIENT (US) 2004-06-16 EP claimed
JP-1221446-A None JP disclosed
JP-56141339-A None JP disclosed
US-9404017-B2 Active-energy-ray-curable hot-melt urethane resin composition, member for electronic device, the member including the resin composition, and packing DIC CORPORATION (JP) 2016-08-02 US disclosed
US-20130158149-A1 ACTIVE-ENERGY-RAY-CURABLE HOT-MELT URETHANE RESIN COMPOSITION, MEMBER FOR ELECTRONIC DEVICE, THE MEMBER INCLUDING THE RESIN COMPOSITION, AND PACKING DIC CORPORATION (JP) 2013-06-20 US disclosed
WO-2005058565-A1 USE OF BENZOTRIAZOLE DERIVATIVES FOR LIGHT-STABILIZING WOODEN SUBSTRATES Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2005-06-30 WO disclosed
JP-H01221446-A RESIN COMPOSITION KURARAY CO LTD 1989-09-04 JP disclosed
EP-0016870-B2 PROCESS FOR POLYMERISING METHYLMETHACRYLATE, LAMINA PRODUCED FROM THIS POLYMER AND ITS USE RÖHM GMBH (DE) 1987-08-12 EP disclosed
US-4593064-A Radiation resistance; polymerizing methyl methacrylate in presence of a free radical catalyst and steric hindered amine ROHM GMBH (DE) 1986-06-03 US disclosed
US-4550136-A Method for polymerizing methyl methacrylate ROHM GMBH (DE) 1985-10-29 US disclosed
EP-0016870-B1 PROCESS FOR POLYMERISING METHYLMETHACRYLATE, LAMINA PRODUCED FROM THIS POLYMER AND ITS USE RÖHM GMBH (DE) 1982-04-21 EP disclosed
JP-S56141339-A RESIN COMPOSITION HAVING IMPROVED LIGHT RESISTANCE OJI YUKA GOUSEISHI KK 1981-11-05 JP disclosed
EP-0016870-A1 Process for polymerising methylmethacrylate, lamina produced from this polymer and its use RÖHM GMBH (DE) 1980-10-15 EP disclosed