SCHEMBL10647271

SCHEMBL10647271

C=C(C)C(=O)OC/C=C/CCl

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.41
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.32
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL10500072 1.00 TSHR (0.44) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL5654625 0.89 TSHR (0.52) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL1636584 0.89 TSHR (0.52) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL1636583 0.89 TSHR (0.52) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL5586259 0.82 THRB (0.47) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL472711 0.82 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL7673065 0.82 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL6817186 0.82 TSHR (0.45) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL453100 0.79 TSHR (0.47) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL37916 0.79 TSHR (0.47) TSHRTHRBALDH1A1TDP1POLB

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
US-4725629-A Process of making an interpenetrating superabsorbent polyurethane foam KIMBERLY-CLARK CORPORATION (US) 1988-02-16 US disclosed
US-4379838-A Photosensitive photographic recording material comprising a dyed layer AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1983-04-12 US disclosed
US-4353972-A ACRYLIC ESTER POLYMER CONTAINING QUATERNARY AMMONIUM OR PHOSPHONIUM GROUPS AGFA-GEVAERT AG (DE) 1982-10-12 US disclosed
US-4260812-A Process for the preparation of halogen butenyl acrylates BAYER AKTIENGESELLSCHAFT (DE) 1981-04-07 US disclosed