SCHEMBL5381822

SCHEMBL5381822

[CH2]CCNOC(=O)C(=C)C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.35

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
SCHEMBL7153803 0.83 ALDH1A1 (0.46) ALDH1A1TSHRTHRB
SCHEMBL9347857 0.83 ALDH1A1 (0.46) ALDH1A1TSHRTHRB
SCHEMBL28191775 0.81 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
SCHEMBL28066915 0.81 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
Hydrochloric Acid SCHEMBL4449709 0.81 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
Bromide SCHEMBL28301716 0.81 ALDH1A1 (0.44) ALDH1A1TSHRTHRB
SCHEMBL28555210 0.79
SCHEMBL4609619 0.79 TSHR (0.48) ALDH1A1TSHRTHRB
Hydrochloric Acid SCHEMBL8678387 0.79 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
SCHEMBL9347712 0.79 ALDH1A1 (0.43) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101845116-A Detection of analytes in aqueous environments SENSORS FOR MED & SCIENCE INC 2010-09-29 CN claimed
CN-1446222-A Detection of analytes in aqueous environments SENSORS FOR MED & SCIENCE INC (US) 2003-10-01 CN claimed
CN-105431226-B Microcapsule 高砂香料工业株式会社 2018-01-12 CN disclosed
CN-105765129-A Articles comprising soil adsorbing polymers and processes for making same 宝洁公司 2016-07-13 CN disclosed
CN-103068929-A Particles for electrophoretic displays MERCK PATENT GMBH 2013-04-24 CN disclosed
CN-101528876-B Polymeric coatings and methods for forming them COMMW SCIENT IND RES ORG 2012-08-15 CN disclosed
CN-101341195-B Method for preparing macroporous anion exchange resin 3M INNOVATIVE PROPERTIES CO. (US) 2011-12-14 CN disclosed
CN-101528876-A Polymeric coatings and methods for forming them COMMW SCIENT IND RES ORG (AU) 2009-09-09 CN disclosed
CN-101341195-A Method for preparing macroporous anion exchange resin 3M INNOVATIVE PROPERTIES CO (US) 2009-01-07 CN disclosed
US-7306700-B1 Process for the production of paper AKZO NOBEL NV (NL) 2007-12-11 US disclosed