SCHEMBL9079359

SCHEMBL9079359

C=CC(=O)OC(CCCC)Cn1c(=O)n(CCCCCCO)c(=O)n(CC(CCCC)OC(=O)C=C)c1=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.33
PRKCA P17252 1/20 0.30
PRKCD Q05655 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL9078880 0.97 TSHR (0.33) TSHRHPGDPRKCDTHRATHRB
SCHEMBL328757 0.88 TSHR (0.31) TSHR
SCHEMBL9079243 0.84 TSHR (0.34) TSHRPRKCAPRKCD
SCHEMBL9077737 0.81 TSHR (0.36) TSHRPRKCD
SCHEMBL24495792 0.77 TSHR (0.33) TSHRHPGDTHRB
SCHEMBL152422 0.76 TSHR (0.33) TSHR
SCHEMBL150154 0.75 TSHR (0.34) TSHRHPGDTHRB
SCHEMBL27700851 0.73 TSHR (0.54) TSHRHPGDPRKCAPRKCDTHRA
SCHEMBL10951903 0.72 TSHR (0.41) TSHRHPGDPRKCAPRKCDTHRA
SCHEMBL7537024 0.72 TSHR (0.50) TSHRHPGDTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5494645-A UV-CURING OF A COATED COMPOSITION OF COLLOICAL SILICA, AN UNSATURATED SILANE, A POLYACRYLOYLOXY-CONTAINING COMPOUND, A HYDROXY- AND ACRYLOYLOXY-CONTAINING TRIAZINE AND AN ACYLPHOSPHINE-TYPE PHOTOINITIATOR MITSUBISHI RAYON CO., LTD. (JP) 1996-02-27 US disclosed
US-5449702-A Coating composition and process for producing abrasion-resistant synthetic resin molded articles MITSUBISHI RAYON CO., LTD. (JP) 1995-09-12 US disclosed