SCHEMBL4358226

SCHEMBL4358226

C=C(C)C(=O)OCCCCCC(CCO)OC(=O)C(=C)C

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
THRB P10828 1/20 0.40
ALDH1A1 P00352 2/20 0.32
NAAA Q02083 1/20 0.32
FAAH O00519 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
RAD52 P43351 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
EPHX1 P07099 1/20 0.30
PRKCA P17252 2/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL31636156 0.91 TSHR (0.73) TSHRPOLBAPEX1HTTTDP1
SCHEMBL31636168 0.91 TSHR (0.73) TSHRPOLBAPEX1HTTTDP1
SCHEMBL31636161 0.88 TSHR (0.68) TSHRPOLBAPEX1HTTTDP1
SCHEMBL129320 0.86 TSHR (0.60) TSHRPOLBAPEX1HTTTDP1
SCHEMBL8438576 0.86 TSHR (0.65) TSHRPOLBAPEX1HTTTDP1
SCHEMBL18762136 0.86 TSHR (0.50) TSHRFAAHPRKCA
SCHEMBL9305321 0.86 TSHR (0.50) TSHRFAAHPRKCA
SCHEMBL10458401 0.85 TSHR (0.69) TSHRPOLBAPEX1HTTTDP1
SCHEMBL31636197 0.85 TSHR (0.63) TSHRPOLBAPEX1HTTTDP1
SCHEMBL31636165 0.85 TSHR (0.63) TSHRPOLBAPEX1HTTTDP1

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
US-8293046-B2 Process for production of porous body and uses thereof JMS CO., LTD. (JP) 2012-10-23 US disclosed
US-20090319016-A1 PROCESS FOR PRODUCTION OF POROUS BODY AND USES THEREOF JMS CO., LTD. (JP) 2009-12-24 US disclosed
EP-2100915-A1 PROCESS FOR PRODUCTION OF POROUS BODY AND USES THEREOF JMS Co., Ltd. (JP) 2009-09-16 EP disclosed