SCHEMBL2906191

SCHEMBL2906191

C=C(CCC1CO1)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TSHR P16473 1/20 0.38
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GLO1 Q04760 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
SCHEMBL25303875 0.87 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL10681047 0.87 ALDH1A1 (0.44) ALDH1A1TSHRTP53CYP3A4
SCHEMBL4370789 0.86 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4
SCHEMBL4921148 0.84 ALDH1A1 (0.61) ALDH1A1TP53CYP3A4
SCHEMBL1685755 0.84 TSHR (0.42) ALDH1A1TSHR
SCHEMBL1270626 0.82 ALDH1A1 (0.44) ALDH1A1TP53CYP3A4
SCHEMBL156677 0.82 ALDH1A1 (0.49) ALDH1A1TSHRMAPTTP53CYP3A4
SCHEMBL8007275 0.82 ALDH1A1 (0.40) ALDH1A1
SCHEMBL9453047 0.81 ALDH1A1 (0.41) ALDH1A1TSHRTP53CYP3A4
SCHEMBL13836064 0.81 ALDH1A1 (0.37) ALDH1A1TSHRMAPTNPSR1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109225341-B Preparation method and application of visible light response magnetic metal organic framework material 浙江大学宁波理工学院 2021-04-30 CN claimed
CN-109225341-B Preparation method and application of visible light response magnetic metal organic framework material 浙江大学宁波理工学院 2021-04-30 CN disclosed
EP-2213703-B1 AROMATIC POLYCARBONATE RESIN COMPOSITION TEIJIN LTD (JP) 2018-05-16 EP disclosed
US-20100222486-A1 AROMATIC POLYCARBONATE RESIN COMPOSITION TEIJIN CHEMICALS LTD. (JP) 2010-09-02 US disclosed
EP-2213703-A1 AROMATIC POLYCARBONATE RESIN COMPOSITION Teijin Chemicals, Ltd. (JP) 2010-08-04 EP disclosed
US-7700264-B2 Photosensitive resin composition, image forming material and image forming method using thereof NIPPON PAINT CO., LTD. (JP) 2010-04-20 US disclosed
US-20090152516-A1 COLOR FILTER INK, COLOR FILTER INK SET, COLOR FILTER, IMAGE DISPLAY, AND ELECTRONIC APPARATUS SEIKO EPSON CORPORATION (JP) 2009-06-18 US disclosed
US-20070099115-A1 Photosensitive resin composition, image forming material and image forming method using thereof NIPPON PAINT CO., LTD. (JP) 2007-05-03 US disclosed