SCHEMBL9640532

SCHEMBL9640532

Nc1ccc(S(=O)(=O)O)c2c(I)cc(N=Nc3ccc(-c4ccc(N=Nc5cc(I)c6c(S(=O)(=O)O)ccc(N)c6c5O)c(C(=O)O)c4)cc3C(=O)O)c(O)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 4/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
THRB P10828 3/20 0.44
HPGD P15428 3/20 0.44
RECQL P46063 3/20 0.44
BLM P54132 3/20 0.44
TP53 P04637 2/20 0.44
CYP3A4 P08684 2/20 0.44
ALOX15 P16050 2/20 0.44
MAPK1 P28482 2/20 0.44
BRCA1 P38398 2/20 0.44
APP P05067 2/20 0.44
SNCA P37840 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 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
SCHEMBL9640501 1.00 KMT2A (0.44) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639756 0.86 MEN1 (0.45) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9640735 0.86 ALDH1A1 (0.61) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9640709 0.86 ALDH1A1 (0.61) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639769 0.86 MEN1 (0.45) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639346 0.85 MEN1 (0.51) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639365 0.85 MEN1 (0.51) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639638 0.84 KMT2A (0.56) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9639660 0.84 KMT2A (0.56) KMT2AMEN1ALDH1A1HSD17B10MAPT
SCHEMBL9640627 0.79 CYP1A2 (0.43) KMT2AMEN1ALDH1A1HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0287909-B1 AMYLOIDOSIS AND ALZHEIMER'S DISEASE DIAGNOSTIC ASSAY AND REAGENTS THEREFOR SALUTAR, INC. (US) 1992-09-02 EP disclosed
US-5039511-A Amyloidosis and alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1991-08-13 US disclosed
US-5008099-A Amyloidosis and Alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1991-04-16 US disclosed
US-4933156-A Amyloidosis and Alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1990-06-12 US disclosed