SCHEMBL9418256

SCHEMBL9418256

C=C(F)C(=O)OCCCCCCCC

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.69
NAAA Q02083 1/20 0.53
EPHX1 P07099 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HCAR2 Q8TDS4 1/20 0.46
ALDH1A1 P00352 2/20 0.44
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 6/20 0.44
DGKA P23743 1/20 0.44
HTR2C P28335 1/20 0.43

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
SCHEMBL11938098 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL9418241 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL27574952 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL31533758 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL1322024 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL20657022 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL9418254 1.00 TSHR (0.69) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL11035114 0.98 TSHR (0.66) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL1321397 0.92 TSHR (0.57) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL8201795 0.89 TSHR (0.52) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310919-B1 Adhesive composition for biomaterial use DAIKIN IND LTD (JP) 1994-01-05 EP disclosed
US-5061184-A Fluorine-containing acrylic esters; dentistry DAIKIN INDUSTRIES, LTD. (JP) 1991-10-29 US disclosed
EP-0310919-A2 Adhesive composition for biomaterial use DAIKIN INDUSTRIES, LIMITED (JP) 1989-04-12 EP disclosed