SCHEMBL8921144

SCHEMBL8921144

COC(=O)c1ccc(Cl)cc1NC(=O)C[S+]([O-])Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 7/20 0.47
MEN1 O00255 6/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.46
PLA2G2A P14555 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.44
THRB P10828 1/20 0.44
TRPM4 Q8TD43 1/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43

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
SCHEMBL8920196 0.77 MAPT (0.74) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL8920117 0.76 MAPT (0.60) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL8922431 0.76 KDM4E (0.78) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL10362701 0.75 ALDH1A1 (0.72) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL7467356 0.75 KMT2A (0.56) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL1801205 0.75 KDM4E (0.60) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL7464454 0.74 L3MBTL1 (0.73) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL7935548 0.74 KMT2A (0.55) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL6510276 0.74 KMT2A (0.68) MAPTSMN1; SMN2KMT2AMEN1KDM4E
SCHEMBL4733777 0.74 KMT2A (0.55) MAPTSMN1; SMN2KMT2AMEN1KDM4E

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-5633379-A N-METHYLASPARTIC ACID ANTAGONIST CIBA-GEIGY CORPORATION (US) 1997-05-27 US disclosed
EP-0685466-A1 3-Heteroaliphatyle-and 3-hetero-(aryle)-aliphatyle-2(1H)-quinolone derivatives CIBA-GEIGY AG (CH) 1995-12-06 EP disclosed