SCHEMBL28027148

SCHEMBL28027148

CCCCCCCCCCCCOC(=O)/C(C)=C(/C)C(=O)OCCCCCCCCCCCC

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.70
NAAA Q02083 1/20 0.59
EPHX1 P07099 1/20 0.55
RAD52 P43351 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ALDH1A1 P00352 2/20 0.54
CES2 O00748 1/20 0.52
HCAR2 Q8TDS4 1/20 0.50
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.48
ACHE P22303 6/20 0.48
DGKA P23743 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
SCHEMBL10009307 1.00 TSHR (0.70) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL10009304 1.00 TSHR (0.70) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL29220168 1.00 TSHR (0.70) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL29220189 0.98 TSHR (0.67) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL27305492 0.92 TSHR (0.61) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL28329854 0.92 TSHR (0.61) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL11755056 0.91 TSHR (0.66) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL859749 0.91 TSHR (0.66) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL29117622 0.91 TSHR (0.66) TSHRNAAAEPHX1RAD52NPSR1
SCHEMBL21599119 0.91 TSHR (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104937056-A Adhesive composition TOAGOSEI CO LTD 2015-09-23 CN disclosed