SCHEMBL28919024

SCHEMBL28919024

CCOC(=O)c1csc(N2CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)n1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.49
▸ OGA O60502 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MAPT P10636 4/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ LMNA P02545 4/20 0.45
▸ TSHR P16473 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ THRB P10828 3/20 0.45
▸ TP53 P04637 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL28919018 0.89 THRB (0.51) POLBOGAKDM4EALDH1A1HPGD
SCHEMBL28919038 0.84 CNR1 (0.47) POLBOGAALDH1A1MAPTLMNA
SCHEMBL18003469 0.78 MAPT (0.58) POLBOGAALDH1A1HPGDMAPT
SCHEMBL10466693 0.78 OGA (0.56) POLBOGAALDH1A1HPGDMAPT
SCHEMBL7185606 0.77 ALDH1A1 (0.62) POLBOGAKDM4EALDH1A1HPGD
SCHEMBL29519544 0.77 PCSK9 (0.50) POLBALDH1A1MAPTLMNATHRB
SCHEMBL28599298 0.77 PCSK9 (0.50) POLBALDH1A1MAPTLMNATHRB
SCHEMBL28919053 0.76 MAPT (0.61) POLBALDH1A1MAPTLMNATHRB
SCHEMBL10464669 0.76 ALDH1A1 (0.64) POLBOGAKDM4EALDH1A1HPGD
SCHEMBL1118526 0.76 OGA (0.54) POLBOGAALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115521272-B Benzenesulfonyl piperazine compound and medical application thereof 河北省人民医院 2023-07-21 — — CN disclosed
CN-115521272-A Benzenesulfonyl piperazine compound and medical application thereof 河北省人民医院 2022-12-27 — — CN disclosed
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