SCHEMBL2132844

SCHEMBL2132844

COC(COCCCO)OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
LPAR6 P43657 3/20 0.34
LPAR1 Q92633 3/20 0.34
LPAR4 Q99677 3/20 0.34
LPAR5 Q9H1C0 3/20 0.34
LPAR2 Q9HBW0 3/20 0.34
LPAR3 Q9UBY5 3/20 0.34
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
PRKD3 O94806 1/20 0.32
PRKCG P05129 1/20 0.32
PRKCB P05771 1/20 0.32
PRKCA P17252 1/20 0.32
PRKCH P24723 1/20 0.32
PRKCI P41743 1/20 0.32
PRKCE Q02156 1/20 0.32

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
SCHEMBL3505033 0.85 TSHR (0.45) USP2TSHRHTTMEN1THRB
SCHEMBL5788545 0.81
SCHEMBL30244421 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL30380499 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL30244896 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL5531243 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL2936139 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL30244716 0.81 MEN1 (0.52) TSHRHTTMEN1THRBKMT2A
SCHEMBL10608927 0.79 TDP1 (0.36) USP2TSHRLPAR6LPAR1LPAR4
SCHEMBL4742703 0.79 TSHR (0.39) TSHRHTTMEN1THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2629807-B1 WATER-BASED AIR FRESHENER COMPOSITIONS AGILEX FLAVOR&FRAGRANCES (US) 2017-04-12 EP disclosed
US-9511165-B2 Water-based air freshener compositions, systems, and methods of use thereof AGILEX FLAVOR & FRAGRANCES (US) 2016-12-06 US disclosed
EP-2629807-A2 WATER-BASED AIR FRESHENER COMPOSITIONS, SYSTEMS, AND METHODS OF USE THEREOF Agilex Flavor&Fragrances (US) 2013-08-28 EP disclosed
US-8492562-B2 (Meth)acrylate derivative, intermediate thereof, and polymer compound KURARAY CO., LTD. (JP) 2013-07-23 US disclosed
US-8431722-B2 Acrylate ester derivatives and polymer compounds KURARAY CO., LTD. (JP) 2013-04-30 US disclosed
US-8362169-B2 Acrylate ester derivatives and polymer compounds KURARAY CO., LTD. (JP) 2013-01-29 US disclosed
US-20120316349-A1 ACRYLATE ESTER DERIVATIVES AND POLYMER COMPOUNDS KURARAY CO., LTD. (JP) 2012-12-13 US disclosed
US-20120097754-A1 WATER-BASED AIR FRESHENER COMPOSITIONS, SYSTEMS, AND METHODS OF USE THEREOF ANTARES CAPITAL LP, AS SUCCESSOR AGENT 2012-04-26 US disclosed
WO-2012054939-A2 WATER-BASED AIR FRESHENER COMPOSITIONS, SYSTEMS, AND METHODS OF USE THEREOF AGILEX FLAVOR & FRAGRANCES (US) 2012-04-26 WO disclosed
US-20110060112-A1 ACRYLATE ESTER DERIVATIVES AND POLYMER COMPOUNDS KURARAY CO., LTD. (JP) 2011-03-10 US disclosed
US-20100331508-A1 (METH)ACRYLATE DERIVATIVE, INTERMEDIATE THEREOF, AND POLYMER COMPOUND KURARAY CO., LTD. (JP) 2010-12-30 US 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 (3 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-20100331508-A1 (METH)ACRYLATE DERIVATIVE, INTERMEDIATE THEREOF, AND POLYMER COMPOUND MTR, WDR1, WDR3 USP2 2323/4885TSHR 950/4885LPAR6 3284/4885
US-20120316349-A1 ACRYLATE ESTER DERIVATIVES AND POLYMER COMPOUNDS ADH1A, ADH1C, ADH5 USP2 3067/4885TSHR 845/4885LPAR6 3505/4885
US-20110060112-A1 ACRYLATE ESTER DERIVATIVES AND POLYMER COMPOUNDS RAD51, LBR, RPLP0 USP2 1965/4885TSHR 2990/4885LPAR6 2851/4885

“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.