SCHEMBL8942555

SCHEMBL8942555

CS(=O)(=O)Nc1cc(NC(=O)CN2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])cc1Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.49
MEN1 O00255 4/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.49
KDM4E B2RXH2 2/20 0.49
TSHR P16473 2/20 0.49
MAPK1 P28482 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
HPGD P15428 2/20 0.49
MLNR O43193 1/20 0.49
MMP1 P03956 1/20 0.49
MPO P05164 1/20 0.49
GLA P06280 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CYP19A1 P11511 1/20 0.49
TBXA2R P21731 1/20 0.49
PTGS1 P23219 1/20 0.49
SLC6A2 P23975 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
SCHEMBL8942460 0.85 MAPT (0.56) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942347 0.84 MAPT (0.55) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942209 0.83 MAPT (0.53) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942431 0.83 SMN1; SMN2 (0.54) KMT2AMEN1LMNAMAPTKDM4E
Hydrochloric Acid SCHEMBL8942526 0.83 MAPT (0.54) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942456 0.83 SMN1; SMN2 (0.52) KMT2AMEN1LMNAMAPTKDM4E
Hydrochloric Acid SCHEMBL8942296 0.82 SMN1; SMN2 (0.51) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL9574619 0.82 SMN1; SMN2 (0.60) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942553 0.81 PDE4B (0.54) KMT2AMEN1LMNAMAPTKDM4E
SCHEMBL8942502 0.81 KMT2A (0.50) KMT2AMEN1LMNAMAPTKDM4E

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
US-5521311-A USEFUL AS ANTIINFLAMMATORY AGENTS, ANTIPYRETICS, ANALGESICS AND ANTI-ALLERGENIC AGENTS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1996-05-28 US disclosed
EP-0685461-A1 5-AMINOACETYLAMINOSULFONANILIDE COMPOUND TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-12-06 EP disclosed