SCHEMBL1798323

SCHEMBL1798323

C=C(C)C(=O)OCCCNO

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
THRB P10828 1/20 0.50
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 3/20 0.43
ACHE P22303 7/20 0.32
HPGD P15428 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL16588235 0.88 THRB (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL107954 0.84 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL182045 0.83 TSHR (0.72) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5144090 0.83 TSHR (0.79) TSHRTHRBPOLBAPEX1HTT
SCHEMBL25426 0.83 TSHR (0.79) TSHRTHRBPOLBAPEX1HTT
SCHEMBL2720435 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16309330 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL8748019 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
Hydrochloric Acid SCHEMBL6053163 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12651026 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4111870-A PRIMER COMPOSITION OF AN ACRYLIC EPOXY ESTER GRAFT COPOLYMER, A HIGH MOLECULAR WEIGHT EPOXY RESIN AND A HEAT REACTIVE CONDENSATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-09-05 US claimed
US-7951429-B2 High energy curable coatings comprising thermoplastic polymers THE SHERWIN-WILLIAMS COMPANY (US) 2011-05-31 US disclosed
US-20090214877-A1 HIGH ENERGY CURABLE COATINGS COMPRISING THERMOPLASTIC POLYMERS THE SHERWIN-WILLIAMS COMPANY (US) 2009-08-27 US disclosed
US-7527864-B2 High energy curable coatings comprising thermoplastic polymers THE SHERWIN-WILLIAMS COMPANY (US) 2009-05-05 US disclosed
US-20050209358-A1 High energy curable coatings comprising thermoplastic polymers SHERWIN-WILLIAMS COMPANY THE 2005-09-22 US disclosed
US-4111870-A PRIMER COMPOSITION OF AN ACRYLIC EPOXY ESTER GRAFT COPOLYMER, A HIGH MOLECULAR WEIGHT EPOXY RESIN AND A HEAT REACTIVE CONDENSATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-09-05 US disclosed