SCHEMBL9955486

SCHEMBL9955486

CCCCCCCCCCCCCCCCCOC(=O)C(=O)OCCCCCCCCCCCCCCCCC

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.72
NAAA Q02083 1/20 0.67
EPHX1 P07099 1/20 0.61
RAD52 P43351 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
HCAR2 Q8TDS4 1/20 0.55
ALDH1A1 P00352 2/20 0.54
DGKA P23743 1/20 0.54
ACHE P22303 6/20 0.54
FAAH O00519 1/20 0.53
LMNA P02545 1/20 0.53
CES2 O00748 1/20 0.52

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
SCHEMBL7959394 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL2456606 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL1960710 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL6834546 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL15987888 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL9955169 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL9955198 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL457867 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL2454309 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL2456648 1.00 TSHR (0.72) TSHRNAAAEPHX1RAD52NPSR1

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
EP-2772523-B1 REVERSIBLY THERMOCHROMIC COMPOSITION PILOT CORPORATION KK (JP) 2018-11-28 EP disclosed
US-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed
US-20140291585-A1 REVERSIBLY THERMOCHROMIC COMPOSITION KABUSHIKI KAISHA PILOT CORPORATION (JP) 2014-10-02 US disclosed
EP-2772523-A1 REVERSIBLY THERMOCHROMIC COMPOSITION Kabushiki Kaisha Pilot Corporation (JP) 2014-09-03 EP disclosed
EP-2655511-A1 THERMOPLASTIC ELASTOMER COMPOSITION AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2013-10-30 EP disclosed
WO-2012084914-A1 THERMOPLASTIC ELASTOMER COMPOSITION AND METHOD FOR THE PRODUCTION THEREOF BASF SE (DE) 2012-06-28 WO disclosed