SCHEMBL28919065

SCHEMBL28919065

O=C(O)c1ccc(C(=O)N2CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.61
▸ CNR1 P21554 1/20 0.60
▸ LMNA P02545 2/20 0.54
▸ ATM Q13315 1/20 0.51
▸ CASP6 P55212 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MET P08581 5/20 0.51
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ CA14 Q9ULX7 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL28919016 0.85 PKLR (0.65) POLBLMNACASP6MEN1KMT2A
SCHEMBL28919051 0.84 POLB (0.56) POLBCNR1LMNAATMMEN1
SCHEMBL28919039 0.83 CNR1 (0.53) POLBCNR1LMNAATMMEN1
SCHEMBL28919066 0.83 CNR1 (0.57) POLBCNR1LMNAATMMEN1
SCHEMBL30080684 0.82 POLB (0.60) POLBCNR1ATMMEN1KMT2A
SCHEMBL28919079 0.81 CNR1 (0.51) POLBCNR1LMNAATMMEN1
SCHEMBL28919025 0.78 NR1H4 (0.58) POLBCNR1LMNAATMMEN1
SCHEMBL30080500 0.78 NR1H4 (0.58) POLBCNR1LMNAATMMEN1
SCHEMBL28919081 0.78 KMT2A (0.54) POLBCNR1ATMMEN1KMT2A
SCHEMBL18711450 0.78 CNR1 (0.68) POLBCNR1ATMMEN1KMT2A

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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