SCHEMBL28919051

SCHEMBL28919051

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

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.56
▸ CNR1 P21554 1/20 0.55
▸ MET P08581 5/20 0.50
▸ LMNA P02545 1/20 0.50
▸ GLA P06280 1/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ HPGD P15428 1/20 0.48
▸ ATM Q13315 1/20 0.47

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
SCHEMBL28919059 0.86 PKLR (0.60) POLBLMNAGLAMEN1KMT2A
SCHEMBL29043230 0.85 MAPT (0.55) CNR1LMNAGLAMEN1KMT2A
SCHEMBL28919065 0.84 POLB (0.61) POLBCNR1METLMNAMEN1
SCHEMBL28919160 0.83 POLB (0.53) POLBLMNAGLAMEN1KMT2A
SCHEMBL8658563 0.79 HPGD (0.68) POLBLMNAKMT2AALDH1A1HPGD
SCHEMBL18711450 0.77 CNR1 (0.68) POLBCNR1METMEN1KMT2A
SCHEMBL18702062 0.76 CNR1 (0.63) POLBCNR1LMNAMEN1KMT2A
SCHEMBL7069343 0.76 F10 (0.61) LMNAGLAALDH1A1L3MBTL1
SCHEMBL17559469 0.73 HPGD (0.61) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL17559346 0.73 HPGD (0.61) LMNAKMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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