SCHEMBL3833176

SCHEMBL3833176

CCC(CO)(CO)COCCO

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
THRB P10828 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL11276252 0.96 MEN1 (0.48) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL11283465 0.96 MEN1 (0.48) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL16672209 0.90 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL819129 0.90 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL8035913 0.90 THRB (0.47) ALDH1A1THRBMEN1KMT2AHTT
SCHEMBL14287548 0.90 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL8966981 0.86 TSHR (0.38) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL12930136 0.86 MEN1 (0.52) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL18927354 0.86 MEN1 (0.52) ALDH1A1TSHRMAPK1THRBMEN1
SCHEMBL9515106 0.86 THRB (0.40) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916432-B2 Hair bleach composition and hair dye composition KAO CORPORATION (JP) 2005-07-12 US claimed
EP-3371408-B1 HIGH FIRE-RESISTANT POLYISOCYANURATE, AND USE THEREOF TO MANUFACTURE FIRE DOOR OR WINDOW FRAMES AND/OR PROFILES THEREFOR DOORS & MORE S R L (IT) 2022-09-07 EP disclosed
EP-3371408-A1 HIGH FIRE-RESISTANT POLYISOCYANURATE, AND USE THEREOF TO MANUFACTURE FIRE DOOR OR WINDOW FRAMES AND/OR PROFILES THEREFOR Doors & More S.R.L. (IT) 2018-09-12 EP disclosed
WO-2018015938-A1 HIGH FIRE-RESISTANT POLYISOCYANURATE, AND USE THEREOF TO MANUFACTURE FIRE DOOR OR WINDOW FRAMES AND/OR PROFILES THEREFOR DOORS & MORE S.R.L. (IT) 2018-01-25 WO disclosed
US-20170355805-A1 IONIC DIOL, ANTISTATIC POLYURETHANE, AND METHOD OF MAKING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2017-12-14 US disclosed
US-20170088758-A1 POLYURETHANE ADHESIVE LAYERS FOR ELECTRO-OPTIC ASSEMBLIES E INK CORPORATION 2017-03-30 US disclosed
US-20140221561-A1 REACTIVE ALKYD SURFACTANT AND STABLE EMULSIONS MADE THEREFROM DOW GLOBAL TECHNOLOGIES LLC (US) 2014-08-07 US disclosed
US-20140086864-A1 Shampoo Compostion SHISEIDO COMPANY, LTD. (JP) 2014-03-27 US disclosed
CN-102224205-B Wear and impact resistant reflective road lane markers DOW GLOBAL TECHNOLOGIES INC 2014-02-19 CN disclosed
EP-1813254-B1 Hair bleach composition and hair dye composition KAO CORP (JP) 2009-08-26 EP disclosed
EP-1813254-A2 Hair bleach composition and hair dye composition Kao Corporation (JP) 2007-08-01 EP disclosed
EP-1219285-B1 Hair bleach composition and hair dye composition KAO CORP (JP) 2007-03-28 EP disclosed
US-6916432-B2 Hair bleach composition and hair dye composition KAO CORPORATION (JP) 2005-07-12 US disclosed
US-20020139957-A1 Hair bleach composition and hair dye composition KAO CORPORATION (JP) 2002-10-03 US disclosed
EP-1219285-A2 Hair bleach composition and hair dye composition Kao Corporation (JP) 2002-07-03 EP disclosed
WO-2001014300-A1 PROCESS FOR PRODUCTION OF AN ETHERALCOHOL PERSTORP AB (SE) 2001-03-01 WO disclosed
US-5773194-A PHOTOSENSITIVITY; DURABILITY KONICA CORPORATION (JP) 1998-06-30 US disclosed
EP-0508831-B1 Polymerizable compositions and in-mold cured products using the same TAKEMOTO OIL & FAT CO LTD (JP) 1996-06-19 EP disclosed
EP-0508831-A1 Polymerizable compositions and in-mold cured products using the same Takemoto Yushi Kabushiki Kaisha (JP) 1992-10-14 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 (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-20140086864-A1 Shampoo Compostion TAAR5, PHOSPHO1, SGMS2 ALDH1A1 1816/4885TSHR 4602/4885MAPK1 3806/4885
US-20020139957-A1 Hair bleach composition and hair dye composition OR10J3, LBR, POLL ALDH1A1 302/4885TSHR 2455/4885MAPK1 2398/4885
US-20170355805-A1 IONIC DIOL, ANTISTATIC POLYURETHANE, AND METHOD OF MAKING THE SAME DEGS1, DRD3, DRD1 ALDH1A1 608/4885TSHR 4133/4885MAPK1 1291/4885

“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.