SCHEMBL28363012

SCHEMBL28363012

O=S(=O)(O)CC(CCl)c1ccccc1.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABBR2 O75899 3/20 0.49
▸ GABBR1 Q9UBS5 3/20 0.49
▸ SRC P12931 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP2C19 P33261 1/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ GMNN O75496 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL1859129 0.86 GABBR2 (0.52) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL27509017 0.81 GABBR2 (0.47) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL4601734 0.79 GABBR2 (0.69) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL6728558 0.79 CCR5 (0.50) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL28359336 0.78 CA12 (0.39) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL2935549 0.76 SRC (0.48) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL28614078 0.75 GABBR2 (0.42) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL28614077 0.75 GABBR2 (0.42) GABBR2GABBR1SRCALDH1A1CYP2C19
SCHEMBL5598365 0.75 TSHR (0.48) GABBR2GABBR1NPSR1SMN1; SMN2CYP2D6
SCHEMBL10638198 0.75 LMNA (0.48) SRCALDH1A1CYP2C19NPSR1SMN1; SMN2

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-117264193-B Cationic polyether demulsifier and preparation method thereof 东营众悦石油科技有限公司 2025-01-28 — — CN claimed
CN-117264193-A Cationic polyether demulsifier and preparation method thereof 东营众悦石油科技有限公司 2023-12-22 — — CN claimed
CN-110835522-B Temperature-resistant and salt-resistant type super-thick oil emulsifying viscosity reducer and preparation method thereof 中国石油化工股份有限公司 2022-02-15 — — CN claimed
CN-110835522-A Temperature-resistant and salt-resistant type super-thick oil emulsifying viscosity reducer and preparation method thereof 中国石油化工股份有限公司 2020-02-25 — — CN claimed
CN-117264193-A Cationic polyether demulsifier and preparation method thereof 东营众悦石油科技有限公司 2023-12-22 — — CN disclosed
CN-110835522-B Temperature-resistant and salt-resistant type super-thick oil emulsifying viscosity reducer and preparation method thereof 中国石油化工股份有限公司 2022-02-15 — — CN disclosed
CN-110835522-A Temperature-resistant and salt-resistant type super-thick oil emulsifying viscosity reducer and preparation method thereof 中国石油化工股份有限公司 2020-02-25 — — CN disclosed
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