SCHEMBL28878377

SCHEMBL28878377

CCCCCCCCS(=O)(=O)Cc1cc(C)c(O)c(CS(=O)(=O)CCCCCCCC)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.38
ESR1 P03372 5/20 0.38
ESR2 Q92731 4/20 0.37
CA2 P00918 1/20 0.37
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CES1 P23141 5/20 0.35
FAAH O00519 3/20 0.35
CES2 O00748 2/20 0.35
THRB P10828 1/20 0.34

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
SCHEMBL28065439 1.00 SHBG (0.38) SHBGESR1ESR2CA2KDM4E
Octane SCHEMBL27953761 0.82 SHBG (0.40) SHBGESR1
SCHEMBL30187484 0.78 KAT8 (0.41) ESR1ESR2CA2
SCHEMBL28481982 0.72 ESR1 (0.56) SHBGESR1ESR2CA2KDM4E
SCHEMBL1023488 0.72 PTGS2 (0.55) SHBGESR1KDM4EHPGDALDH1A1
SCHEMBL14822970 0.72 PTGS2 (0.55) SHBGESR1KDM4EHPGDALDH1A1
SCHEMBL1021953 0.70 PTGS2 (0.56) SHBGESR1KDM4EHPGDMEN1
SCHEMBL11648899 0.70 PTGS2 (0.52) SHBGESR1KDM4EHPGDMEN1
SCHEMBL1021651 0.70 PTGS2 (0.53) SHBGESR1KDM4EHPGDALDH1A1
SCHEMBL15488771 0.70 PTGS2 (0.56) SHBGESR1KDM4EHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371719-A Resin additive composition, thermoplastic resin composition, and molded article thereof 株式会社ADEKA 2025-01-28 CN disclosed
CN-118388762-A Imide resin, thermosetting resin composition, and cured product thereof DIC株式会社 2024-07-26 CN disclosed
CN-111971316-B Mixtures of aminosilyl-functionalized styrenes, their preparation and their use in the production of elastomeric copolymers 西索斯公司 2023-07-11 CN disclosed
CN-116323779-A Additive composition, resin composition, method for producing resin composition, and molded article 株式会社ADEKA 2023-06-23 CN disclosed
CN-112955332-B Amino silyl functionalized conjugated dienes, their preparation and use in the manufacture of rubber 西索斯公司 2023-02-21 CN disclosed
CN-115461381-A Acid group-containing (meth) acrylate resin, curable resin composition, insulating material, resin material for solder resist, and resist member DIC株式会社 2022-12-09 CN disclosed
CN-109689792-B Liquid antioxidant composition for raw rubber 巴斯夫欧洲公司 2022-03-29 CN disclosed