SCHEMBL4808939

SCHEMBL4808939

CCOCCCCCCCCOCCOC(C(=O)O)C(OCCOCCCCCCCCOCC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
THRB P10828 2/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
SELP P16109 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
CES2 O00748 2/20 0.36
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL28645812 0.84 ALDH1A1 (0.38) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL18139028 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18139638 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18141449 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18141136 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18140561 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18140433 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18140393 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18139622 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A
SCHEMBL18139074 0.77 MAPT (0.43) TSHRTHRBMEN1HTTKMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180116211-A1 Small-Animal Controlling Resin Composition NIX INC (JP) 2018-05-03 US disclosed
US-20160262378-A1 Small-Animal-Controlling Resin Composition NIX, INC. (JP) 2016-09-15 US disclosed
US-7368123-B1 Pesticidal resin compositions and pesticidal products formed from the same OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2008-05-06 US disclosed
EP-1145632-B1 RESIN COMPOSITIONS FOR CONTROLLING SMALL ANIMALS AND MOLDED MEMBERS FOR CONTROLLING SMALL ANIMALS MADE THEREOF OTSUKA KAGAKU KK (JP) 2007-07-11 EP disclosed
EP-1145632-A1 RESIN COMPOSITIONS FOR CONTROLLING SMALL ANIMALS AND MOLDED MEMBERS FOR CONTROLLING SMALL ANIMALS MADE THEREOF OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2001-10-17 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160262378-A1 Small-Animal-Controlling Resin Composition SEM1, PSMD9, COPE EPHX2 1180/4885ALDH1A1 3298/4885TSHR 3757/4885
US-20180116211-A1 Small-Animal Controlling Resin Composition TAS2R42, SLC43A1, COPE EPHX2 2101/4885ALDH1A1 3403/4885TSHR 2040/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.