SCHEMBL30005377

SCHEMBL30005377

Cc1noc(-c2ccccc2C(=O)Nc2ccc(S(=O)(=O)N3CCN(c4cc(Cl)cc(Cl)c4)CC3)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALDH1A1 P00352 4/20 0.48
POLB P06746 3/20 0.48
ATM Q13315 1/20 0.47
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PSMD14 O00487 1/20 0.45
THRB P10828 1/20 0.45
F13A1 P00488 1/20 0.44
TGM2 P21980 1/20 0.44
TGM1 P22735 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL30005725 0.84 KMT2A (0.48) GAASMN1; SMN2ALDH1A1POLBATM
SCHEMBL30005957 0.82 MAPT (0.49) SMN1; SMN2ALDH1A1POLBATMMAPT
SCHEMBL30005703 0.80 MAPT (0.47) ALDH1A1POLBATMMAPTTDP1
SCHEMBL30005455 0.76 TDP1 (0.52) ALDH1A1POLBATMMAPTTDP1
SCHEMBL30005465 0.76 ALDH1A1 (0.73) SMN1; SMN2ALDH1A1POLBATMMAPT
SCHEMBL30005561 0.74 TDP1 (0.49) ALDH1A1POLBATMMAPTTDP1
SCHEMBL30005953 0.74 TDP1 (0.49) ALDH1A1POLBATMMAPTTDP1
SCHEMBL30005757 0.74 MEN1 (0.51) SMN1; SMN2ALDH1A1POLBATMMAPT
SCHEMBL30005802 0.73 NPC1 (0.55) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL30006561 0.72 MEN1 (0.52) GAASMN1; SMN2ALDH1A1ATMMAPT

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
WO-2022220725-A1 LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS ZAMARATSKI EDOUARD (SE) 2022-10-20 WO disclosed