SCHEMBL3345135

SCHEMBL3345135

C=C(C)C(=O)OC(=O)C(C)=CCC

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
THRB P10828 1/20 0.38
TSHR P16473 4/20 0.37
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL5317265 0.89 ALDH1A1 (0.38) ALDH1A1TSHRCYP2D6CYP2C19TDP1
SCHEMBL10825002 0.89 ALDH1A1 (0.38) ALDH1A1TSHRCYP2D6CYP2C19TDP1
SCHEMBL7522645 0.87 ALDH1A1 (0.36) ALDH1A1TSHRCYP2D6CYP2C19TDP1
SCHEMBL9245453 0.87 ALDH1A1 (0.36) ALDH1A1TSHRCYP2D6CYP2C19TDP1
SCHEMBL9363621 0.86 CYP2D6 (0.33) CYP2D6CYP2C19TDP1HSD17B10
SCHEMBL5167976 0.83 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL28758133 0.82 ALDH1A1 (0.38) ALDH1A1THRBTSHRTDP1HSD17B10
SCHEMBL6425465 0.81 TSHR (0.44) ALDH1A1THRBTSHRCYP2D6CYP2C19
SCHEMBL5075300 0.81 ALDH1A1 (0.41) ALDH1A1THRBTSHRTDP1HSD17B10
SCHEMBL6137522 0.81 ALDH1A1 (0.41) ALDH1A1THRBTSHRTDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718168-B2 Medical implant materials containing immobilized transglutaminase ASTON UNIVERSITY (GB) 2010-05-18 US claimed
EP-1280563-B1 MEDICAL IMPLANT MATERIALS UNIV ASTON (GB) 2006-12-13 EP claimed
US-20040030408-A1 Medical implant materials ASTON UNIVERSITY (GB) 2004-02-12 US claimed
EP-1280563-A1 MEDICAL IMPLANT MATERIALS The Nottingham Trent University (GB) 2003-02-05 EP claimed
WO-2001085224-A1 MEDICAL IMPLANT MATERIALS THE NOTTINGHAM TRENT UNIVERSITY (GB) 2001-11-15 WO claimed
CN-109207010-A A kind of preparation method of Waterproof Breathable raincoat 安徽宝玉雨具有限公司 2019-01-15 CN disclosed
CN-109075294-A Non-aqueous secondary battery functional layer composition, non-aqueous secondary battery functional layer and non-aqueous secondary battery 日本瑞翁株式会社 2018-12-21 CN disclosed
US-9657110-B2 Polypeptides and use thereof ASTON UNIVERSITY (GB) 2017-05-23 US disclosed
EP-2701726-A1 NOVEL POLYPEPTIDES AND USE THEREOF Aston University (GB) 2014-03-05 EP disclosed
WO-2012146901-A1 NOVEL POLYPEPTIDES AND USE THEREOF ASTON UNIVERSITY (GB) 2012-11-01 WO disclosed
US-7718168-B2 Medical implant materials containing immobilized transglutaminase ASTON UNIVERSITY (GB) 2010-05-18 US disclosed
EP-1280563-B1 MEDICAL IMPLANT MATERIALS UNIV ASTON (GB) 2006-12-13 EP disclosed
US-20040030408-A1 Medical implant materials ASTON UNIVERSITY (GB) 2004-02-12 US disclosed
EP-1280563-A1 MEDICAL IMPLANT MATERIALS The Nottingham Trent University (GB) 2003-02-05 EP disclosed
WO-2001085224-A1 MEDICAL IMPLANT MATERIALS THE NOTTINGHAM TRENT UNIVERSITY (GB) 2001-11-15 WO disclosed
US-5780055-A BEAD PREPARED FROM MICROCRYSTALLINE CELLULOSE BY EXTRUSION-SPHERONIZATION AND FREEZE DRYING UNIVERSITY OF MARYLAND, BALTIMORE (US) 1998-07-14 US disclosed
WO-1998009597-A2 CUSHIONING BEADS AND TABLET COMPRISING THE SAME CAPABLE OF FORMING A SUSPENSION UNIVERSITY OF MARYLAND BALTIMORE (US) 1998-03-12 WO disclosed
US-5663039-A AT LEAST A PORTION OF THE SURFACE IS COVERED WITH AN ADDITIVE SELECTED FROM THE GROUP CONSISTING OF A SULFITE, A HYDROXYLAMINE OR A BENZOIC OR SULFONIC ACID COMPOUND KONICA CORPORATION (JP) 1997-09-02 US disclosed