SCHEMBL28569358

SCHEMBL28569358

C=C(C)C(=O)OC(COCC)COCC

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
TSHR P16473 5/20 0.44
ALDH1A1 P00352 6/20 0.38
LMNA P02545 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL3648810 0.82 THRB (0.48) THRBTSHRALDH1A1
SCHEMBL28180557 0.82 THRB (0.48) THRBTSHRALDH1A1
SCHEMBL15385984 0.82 MTNR1A (0.43) THRBLMNA
SCHEMBL11434772 0.81 THRB (0.47) THRBTSHRALDH1A1
SCHEMBL28538695 0.80 TDP1 (0.45) THRBTSHRALDH1A1LMNA
SCHEMBL18741139 0.79 THRB (0.46) THRBTSHRALDH1A1
SCHEMBL27750573 0.79 THRB (0.46) THRBTSHRALDH1A1
SCHEMBL3952800 0.79 TSHR (0.40) THRBTSHRALDH1A1
SCHEMBL14546264 0.79 TSHR (0.47) THRBTSHRALDH1A1
SCHEMBL35507 0.79 TSHR (0.63) THRBTSHRALDH1A1LMNA

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
CN-112279959-B Ophthalmic polymer material, method for the production and use thereof 康小林 2022-05-03 CN claimed
CN-112279959-A Ophthalmic polymer material, method for the production and use thereof 康小林 2021-01-29 CN claimed
CN-114075122-B Hydrophilic azo compound and application thereof 康小林 2024-01-02 CN disclosed
CN-112279959-B Ophthalmic polymer material, method for the production and use thereof 康小林 2022-05-03 CN disclosed
CN-114075122-A Hydrophilic azo compound and application thereof 康小林 2022-02-22 CN disclosed
CN-112279959-A Ophthalmic polymer material, method for the production and use thereof 康小林 2021-01-29 CN disclosed