SCHEMBL28895340

SCHEMBL28895340

CCCCC(C(=O)O)(C(=O)Cl)C(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TP53 P04637 1/20 0.41
FDPS P14324 1/20 0.39
TSHR P16473 5/20 0.38
AKR1B1 P15121 1/20 0.36
GPR84 Q9NQS5 6/20 0.34
PPARG P37231 6/20 0.34
PPARD Q03181 6/20 0.34
PPARA Q07869 6/20 0.34
HDAC11 Q96DB2 5/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 0.34
PTPN1 P18031 2/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
MEN1 O00255 1/20 0.34
ESR1 P03372 1/20 0.34
ALOX15 P16050 1/20 0.34
PDE4A P27815 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
SCHEMBL628993 0.88 ALDH1A1 (0.46) ALDH1A1TP53FDPSTSHRAKR1B1
SCHEMBL28435686 0.86 TSHR (0.36) ALDH1A1TP53FDPSTSHRTDP1
SCHEMBL543959 0.85 AKR1B1 (0.42) ALDH1A1TSHRAKR1B1GPR84PPARG
Hydrochloric Acid SCHEMBL628994 0.83 AKR1B1 (0.40) ALDH1A1TSHRAKR1B1GPR84PPARG
Hydrochloric Acid SCHEMBL28895341 0.83 AKR1B1 (0.40) ALDH1A1TSHRAKR1B1GPR84PPARG
Hydrochloric Acid SCHEMBL3267369 0.83 AKR1B1 (0.40) ALDH1A1TSHRAKR1B1GPR84PPARG
SCHEMBL6134859 0.81 ALDH1A1 (0.46) ALDH1A1TP53FDPSTSHRCES1
SCHEMBL28898288 0.79 ALDH1A1 (0.50) ALDH1A1FDPSTSHR
SCHEMBL29083 0.78 AKR1B1 (0.46) ALDH1A1TSHRAKR1B1GPR84PPARG
SCHEMBL18833126 0.77 AKR1B1 (0.41) ALDH1A1TSHRAKR1B1GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113600029-A Antibacterial polyamide water treatment membrane with quaternary phosphonium salt and preparation method thereof 苏州普希环保科技有限公司 2021-11-05 CN disclosed
CN-113600030-A Quaternary phosphonium salt antibacterial polyamide separation membrane and preparation method thereof 苏州普希环保科技有限公司 2021-11-05 CN disclosed
CN-113600028-A Nano-silver antibacterial polyamide water treatment membrane and preparation method thereof 苏州普希环保科技有限公司 2021-11-05 CN disclosed
CN-112121646-A Antibacterial polyamide water treatment membrane with quaternary phosphonium salt and preparation method thereof 苏州普希环保科技有限公司 2020-12-25 CN disclosed
CN-112090292-A Quaternary phosphonium salt antibacterial polyamide separation membrane and preparation method thereof 苏州普希环保科技有限公司 2020-12-18 CN disclosed
CN-112090291-A Nano-silver antibacterial polyamide water treatment membrane and preparation method thereof 苏州普希环保科技有限公司 2020-12-18 CN disclosed
CN-111936427-A Sulfate ion removal system and method 日东电工株式会社 2020-11-13 CN disclosed
CN-110314558-B Separation membrane 日东电工株式会社 2020-09-29 CN disclosed
CN-109925890-B Separation membrane 日东电工株式会社 2020-06-19 CN disclosed