SCHEMBL3391731

SCHEMBL3391731

CC1(C)CNCC(C)(C)N1C(CCCCCC(=O)O)(CCC(=O)O)N1C(C)(C)CNCC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
LMNA P02545 2/20 0.36
NFKB1 P19838 1/20 0.36
PMP22 Q01453 1/20 0.36
GPR84 Q9NQS5 8/20 0.36
FFAR1 O14842 2/20 0.36
FFAR4 Q5NUL3 2/20 0.36
PPARG P37231 7/20 0.35
PPARD Q03181 7/20 0.35
PPARA Q07869 7/20 0.35
HDAC11 Q96DB2 5/20 0.35
PTPN1 P18031 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TLR2 O60603 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
FABP4 P15090 2/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
MEN1 O00255 1/20 0.35
ESR1 P03372 1/20 0.35

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
SCHEMBL699481 0.85 TSHR (0.36) TSHRLMNANFKB1PMP22GPR84
Sebacic Acid SCHEMBL27446658 0.75 TSHR (0.50) TSHRLMNANFKB1PMP22GPR84
Sebacic Acid SCHEMBL8067661 0.66 TSHR (0.48) TSHRLMNANFKB1PMP22GPR84
Sebacic Acid SCHEMBL2344968 0.66 TSHR (0.48) TSHRLMNANFKB1PMP22GPR84
SCHEMBL11805663 0.66 APEX1 (0.38) LMNAALDH1A1MEN1KMT2AHSD17B10
Adipic Acid SCHEMBL6543544 0.64 LMNA (0.46) TSHRLMNANFKB1PMP22GPR84
SCHEMBL6663525 0.63 TSHR (0.55) TSHRLMNANFKB1PMP22GPR84
SCHEMBL14360000 0.63 TDP1 (0.58) TSHRLMNANFKB1PMP22GPR84
SCHEMBL27628078 0.63 TDP1 (0.58) TSHRLMNANFKB1PMP22GPR84
Sebacic Acid SCHEMBL28249279 0.63 TSHR (0.80) TSHRLMNANFKB1PMP22GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426410-B1 PLASTICIZED THERMOPLASTIC RESIN COMPOSITION OF GOOD FLEXIBILITY BASF CORP (US) 2010-12-22 EP disclosed
EP-1150357-B1 COVER MATERIAL FOR SOLAR CELL BRIDGESTONE CORP (JP) 2005-03-02 EP disclosed
US-20040162392-A1 Thermoplastic resin composition JOHNSON POLYMER, LLC 2004-08-19 US disclosed
EP-1426410-A1 THERMOPLASTIC RESIN COMPOSITION TOAGOSEI CO., LTD. (JP) 2004-06-09 EP disclosed
US-6441299-B2 Covering member for solar battery BRIDGESTONE CORPORATION (JP) 2002-08-27 US disclosed
EP-1150357-A1 COVER MATERIAL FOR SOLAR CELL, SEALING FILM AND SOLAR CELL Bridgestone Corporation (JP) 2001-10-31 EP disclosed
US-20010009160-A1 Covering member for solar battery, sealing film and solar battery BRIDGESTONE CORPORATION 2001-07-26 US disclosed