SCHEMBL29031808

SCHEMBL29031808

C=C(C)C(=O)OCC(C)F

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.69
THRB P10828 1/20 0.44
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL145854 0.84 TSHR (0.65) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL14528754 0.83 TSHR (0.64) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL24562 0.82 TSHR (1.00) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL8966000 0.82 TSHR (0.75) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL3319370 0.82 TSHR (0.75) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL615662 0.81 TSHR (0.61) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL20001266 0.80 TSHR (0.72) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL9695772 0.80 TSHR (0.72) TSHRTHRBALDH1A1TDP1POLB
Hydroxyl Radical SCHEMBL28311885 0.80 TSHR (0.95) TSHRTHRBALDH1A1TDP1POLB
SCHEMBL27697323 0.80 TSHR (0.72) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116239974-A Film material and conductive adhesive film using the same 南通德聚半导体材料有限公司 2023-06-09 CN disclosed