SCHEMBL27433006

SCHEMBL27433006

C=CC(=O)OC(CCCCCN=C=O)N=C=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 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
SCHEMBL5163638 0.94 ALDH1A1 (0.30) ALDH1A1CYP3A4TSHR
SCHEMBL17377701 0.84 TSHR (0.40) TSHR
SCHEMBL5358881 0.84 TSHR (0.40) TSHR
SCHEMBL5350733 0.84 TSHR (0.40) TSHR
SCHEMBL9584947 0.84 TSHR (0.40) TSHR
SCHEMBL5358176 0.84 TSHR (0.40) TSHR
SCHEMBL5354708 0.82 TSHR (0.41) TSHR
SCHEMBL27774624 0.81 TSHR (0.34) ALDH1A1CYP3A4TSHR
SCHEMBL27774626 0.81 TSHR (0.34) ALDH1A1CYP3A4TSHR
SCHEMBL28055449 0.81 TSHR (0.34) ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105264010-B Fluorin resin composition, film and article 大金工业株式会社 2018-08-28 CN disclosed
CN-103958627-B Coating, film, the backboard of solar module and solar module 大金工业株式会社 2016-10-19 CN disclosed
CN-1249184-C Pollution prevention coating composition SK KAKEN CO LTD (JP) 2006-04-05 CN disclosed
CN-1105759-C Anti-fouling coating composition SK KAKEN CO LTD (JP) 2003-04-16 CN disclosed