SCHEMBL28481982

SCHEMBL28481982

CCCCCCCCS(=O)(=O)Cc1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.56
ESR2 Q92731 4/20 0.56
ALDH1A1 P00352 3/20 0.55
ADRA2A P08913 2/20 0.55
ADORA3 P0DMS8 2/20 0.55
TACR2 P21452 2/20 0.55
SLC6A2 P23975 2/20 0.55
SLC6A4 P31645 2/20 0.55
SLC6A3 Q01959 2/20 0.55
LMNA P02545 2/20 0.55
KDM4E B2RXH2 2/20 0.55
TP53 P04637 2/20 0.55
CYP3A4 P08684 2/20 0.55
HSD17B10 Q99714 2/20 0.55
SHBG P04278 1/20 0.55
HSPD1 P10809 1/20 0.55
ADRB3 P13945 1/20 0.55
HTR2C P28335 1/20 0.55
HSPE1 P61604 1/20 0.55
HIF1A Q16665 1/20 0.55

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
SCHEMBL28229654 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL8778812 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL8778800 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL8778824 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL1010109 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL8778866 0.82 MMP1 (0.47) ALDH1A1KMT2AHPGDCA2
SCHEMBL6019496 0.80 ALDH1A1 (0.47) ALDH1A1KMT2AHPGDSMN1; SMN2CA2
SCHEMBL21316546 0.80 MMP13 (0.46) KMT2AMEN1
SCHEMBL27921938 0.80 ALDH1A1 (0.41) ESR1ESR2ALDH1A1LMNAKMT2A
SCHEMBL30187484 0.80 KAT8 (0.41) ESR1ESR2CA2

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-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-115605538-A Thermoplastic polymer composition with reduced migration of stabilizers 英力士苯领集团股份公司(DE) 2023-01-13 CN disclosed
CN-110382559-B Method for producing stabilized olefin resin composition 株式会社ADEKA 2021-10-29 CN disclosed
CN-112955332-A Amino silyl functionalized conjugated dienes, their preparation and use in the manufacture of rubber 西索斯公司 2021-06-11 CN disclosed
CN-111971316-A Mixtures of aminosilyl-functionalized styrenes, their preparation and their use in the production of elastomeric copolymers 西索斯公司 2020-11-20 CN disclosed