SCHEMBL9317634

SCHEMBL9317634

C=C(C)C(=O)OC(F)(F)C(F)CCC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.35
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
SCHEMBL11333430 0.93 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL9303524 0.88 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL216127 0.84 TSHR (0.36) ALDH1A1TSHRTHRB
SCHEMBL9301944 0.83 TSHR (0.41) ALDH1A1TSHRTHRB
SCHEMBL9303668 0.82 TSHR (0.37) ALDH1A1TSHRTHRB
SCHEMBL29019014 0.82 ALDH1A1 (0.47) ALDH1A1TSHR
SCHEMBL28332299 0.81 TSHR (0.32) TSHR
Alcohol SCHEMBL28215508 0.80 TSHR (0.33) ALDH1A1TSHRTHRB
Methacrylic Acid SCHEMBL28063227 0.80 TSHR (0.33) ALDH1A1TSHR
SCHEMBL2784846 0.80 TSHR (0.31) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116404159-A Adhesive, and preparation method and application thereof 上海华谊三爱富新材料有限公司 2023-07-07 CN claimed
CN-116404159-A Adhesive, and preparation method and application thereof 上海华谊三爱富新材料有限公司 2023-07-07 CN disclosed
US-5312710-A Electrophotographic toner and process for producing the same FUJI XEROX CO., LTD. (JP) 1994-05-17 US disclosed