SCHEMBL17536558

SCHEMBL17536558

C=C(C)C(=O)OC.C=C(C)C(=O)OCC1CO1.CCCCOC(=O)C1=CCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TSHR P16473 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ESR1 P03372 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPK1 P28482 1/20 0.32
NR1H2 P55055 1/20 0.32
RNASEL Q05823 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
SCHEMBL3475334 0.96 ALDH1A1 (0.57) ALDH1A1TSHRSMN1; SMN2HPGDRECQL
SCHEMBL931556 0.85 ALDH1A1 (0.64) ALDH1A1TSHRCYP2D6CYP2C19LMNA
SCHEMBL5975243 0.85 ALDH1A1 (0.64) ALDH1A1TSHRCYP2D6CYP2C19CYP3A4
SCHEMBL5614326 0.85 ALDH1A1 (0.68) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL4217401 0.83 ALDH1A1 (0.40) ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL9244699 0.81 ALDH1A1 (0.61) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL5558173 0.81 TSHR (0.47) ALDH1A1TSHRSMN1; SMN2HPGDL3MBTL1
SCHEMBL6939710 0.80 ALDH1A1 (0.76) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL7557454 0.80 ALDH1A1 (0.52) ALDH1A1TSHRPOLBCYP2D6CYP2C19
SCHEMBL461069 0.79 ALDH1A1 (0.58) ALDH1A1TSHRHPGDHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732216-B2 Resin composition and resin molded article FUJI XEROX CO., LTD. (JP) 2017-08-15 US disclosed
US-9695314-B2 Resin composition and resin molded article FUJI XEROX CO., LTD. (JP) 2017-07-04 US disclosed
US-20170114218-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE FUJI XEROX CO., LTD. (JP) 2017-04-27 US disclosed
US-9562157-B2 Resin composition and resin molded article FUJI XEROX CO., LTD. (JP) 2017-02-07 US disclosed
CN-106189163-A Resin combination and resin molded body 富士施乐株式会社 2016-12-07 CN disclosed
CN-105802144-A Resin composition and resin molded article 富士施乐株式会社 2016-07-27 CN disclosed
US-20160208092-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2016-07-21 US disclosed
US-20160185957-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2016-06-30 US disclosed
US-20160060456-A1 RESIN COMPOSITION AND RESIN MOLDED ARTICLE FUJIFILM BUSINESS INNOVATION CORP. (JP) 2016-03-03 US disclosed