SCHEMBL23104919

SCHEMBL23104919

C=C(C)C(=O)OCCCCC1C2CC(CCOC(=O)C(=C)C)C(C2)C1CC

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.44
▸ THRB P10828 1/20 0.36
▸ POLB P06746 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 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
SCHEMBL23059633 0.79 TSHR (0.44) TSHRTHRBALDH1A1
SCHEMBL24167715 0.73 THRB (0.37) TSHRTHRBALDH1A1
SCHEMBL23784436 0.73 THRB (0.37) TSHRTHRBALDH1A1
SCHEMBL22267296 0.72 THRB (0.36) TSHRTHRBALDH1A1
SCHEMBL21886544 0.72 THRB (0.36) TSHRTHRBALDH1A1
SCHEMBL22267237 0.72 THRB (0.36) TSHRTHRBALDH1A1
SCHEMBL12511467 0.72 THRB (0.43) TSHRTHRBALDH1A1
SCHEMBL12002689 0.72 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL18634056 0.71 THRB (0.36) TSHRTHRBALDH1A1
SCHEMBL13991632 0.70 TSHR (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210079219-A1 MALEIMIDE RESIN COMPOSITION AND MALEIMIDE RESIN FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-03-18 — — US disclosed
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