SCHEMBL30005725

SCHEMBL30005725

Cc1noc(-c2cccc(C(=O)Nc3ccc(S(=O)(=O)N4CCN(c5cc(Cl)cc(Cl)c5)CC4)cc3)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
GAA P10253 3/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 6/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 3/20 0.47
NPC1 O15118 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TRPV4 Q9HBA0 1/20 0.45

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
SCHEMBL30005377 0.84 GAA (0.49) KMT2AMEN1GAAALDH1A1POLB
SCHEMBL30005899 0.78 GAA (0.59) KMT2AMEN1GAALMNAMAPK1
SCHEMBL30005557 0.76 ALDH1A1 (0.58) KMT2AMEN1GAALMNAMAPK1
SCHEMBL30005697 0.73 LMNA (0.56) KMT2AMEN1GAALMNAMAPK1
SCHEMBL31518593 0.72 LMNA (0.44) KMT2AMEN1GAALMNAMAPK1
SCHEMBL31252083 0.71 TRPV4 (0.58) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL30005757 0.69 MEN1 (0.51) KMT2AMEN1LMNAALDH1A1POLB
SCHEMBL30005957 0.69 MAPT (0.49) KMT2AMEN1ALDH1A1POLBSMN1; SMN2
SCHEMBL30005455 0.69 TDP1 (0.52) KMT2AMEN1ALDH1A1POLBTDP1
SCHEMBL30005465 0.69 ALDH1A1 (0.73) KMT2AMEN1ALDH1A1POLBSMN1; 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 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