SCHEMBL4325855

SCHEMBL4325855

C=CC(=O)OCCCCC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
ALDH1A1 P00352 6/20 0.53
CYP3A4 P08684 3/20 0.53
HPGD P15428 1/20 0.45
TP53 P04637 4/20 0.41
HIF1A Q16665 3/20 0.41
HSD17B10 Q99714 1/20 0.41
EPHX1 P07099 2/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.33
MITF O75030 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NLRP1 Q9C000 1/20 0.33

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
SCHEMBL8408099 0.89 TSHR (0.44) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL6236200 0.84 TSHR (0.53) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL4872016 0.77 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL29602252 0.76 TSHR (0.58) TSHRALDH1A1CYP3A4HPGDEPHX1
SCHEMBL18518850 0.76 TSHR (0.58) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9650762 0.75 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL27557371 0.74 TSHR (0.47) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9062773 0.74 TSHR (0.60) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL10894893 0.74 TSHR (0.55) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL244114 0.74 TSHR (0.95) TSHRALDH1A1CYP3A4HPGDTP53

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
EP-2003174-B1 HARD COATING COMPOSITION FOR METAL BASE FUJIKURA KASEI KK (JP) 2018-05-02 EP claimed
US-9567676-B2 Hard coating composition for metal substrate FUJIKURA KASEI CO., LTD. (JP) 2017-02-14 US claimed
EP-2003174-B1 HARD COATING COMPOSITION FOR METAL BASE FUJIKURA KASEI KK (JP) 2018-05-02 EP disclosed
US-9567676-B2 Hard coating composition for metal substrate FUJIKURA KASEI CO., LTD. (JP) 2017-02-14 US disclosed
EP-2677009-B1 HARD-COAT COMPOSITION FOR METAL SUBSTRATE, AND MOLDED ARTICLE FUJIKURA KASEI KK (JP) 2016-09-14 EP disclosed
US-9012023-B2 Hard coat coating composition for metal base material and molded product FUJIKURA KASEI CO., LTD. (JP) 2015-04-21 US disclosed
EP-2677009-A1 HARD-COAT COMPOSITION FOR METAL SUBSTRATE, AND MOLDED ARTICLE Fujikura Kasei Co., Ltd. (JP) 2013-12-25 EP disclosed
US-20130309510-A1 HARD COAT COATING COMPOSITION FOR METAL BASE MATERIAL AND MOLDED PRODUCT FUJIKURA KASEI CO., LTD. (JP) 2013-11-21 US disclosed
US-20090054544-A1 HARD COATING COMPOSITION FOR METAL SUBSTRATE FUJIKURA KASEI CO., LTD. (JP) 2009-02-26 US disclosed
EP-2003174-A1 HARD COATING COMPOSITION FOR METAL BASE FUJIKURA KASEI CO., LTD. (JP) 2008-12-17 EP disclosed