Sugi Predict

Sugi Predict / Compounds / SCHEMBL10700658

SCHEMBL10700658

SCHEMBL10700658

C=C(OOCCCCCC)C(=O)OC(C)OC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.41
▸ LMNA P02545 2/20 0.35
▸ ACE2 Q9BYF1 1/20 0.34
▸ NAAA Q02083 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ CES2 O00748 1/20 0.33
▸ EPHX1 P07099 1/20 0.32
▸ PLA2G2A P14555 1/20 0.31
▸ TP53 P04637 1/20 0.31

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
SCHEMBL10701520 0.99 TSHR (0.38) TSHRLMNAACE2NAAAHCAR2
SCHEMBL10702825 0.94 TSHR (0.33) TSHRLMNA
SCHEMBL10697975 0.93 TSHR (0.36) TSHRLMNAACE2
SCHEMBL10716035 0.89 TSHR (0.31) TSHR
SCHEMBL19092937 0.75 TSHR (0.56) TSHRLMNANAAAHCAR2CES2
SCHEMBL10699697 0.75 TSHR (0.36) TSHRLMNANAAAHCAR2CES2
SCHEMBL27572509 0.73 TSHR (0.45) TSHRLMNANAAAHCAR2CES2
SCHEMBL9461649 0.72 NAAA (0.48) TSHRNAAAHCAR2CES2EPHX1
SCHEMBL28816424 0.72 NAAA (0.48) TSHRNAAAHCAR2CES2EPHX1
SCHEMBL8512927 0.72 NAAA (0.48) TSHRNAAAHCAR2CES2EPHX1

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
EP-0289933-A2 Graft polymerization precurser and method manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-11-09 — — EP disclosed