SCHEMBL6404302

SCHEMBL6404302

CS(=O)(=O)c1ccc(C(=O)NCc2cc(CCl)no2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.48
NR1H4 Q96RI1 1/20 0.48
ALDH1A1 P00352 3/20 0.42
PKM P14618 1/20 0.42
NAMPT P43490 2/20 0.42
HTT P42858 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
RORC P51449 1/20 0.40
KDM4E B2RXH2 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6409368 0.85 TDP1 (0.52) ALDH1A1NAMPTHTTKMT2AMEN1
SCHEMBL6410530 0.84 MAPT (0.44) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL6403590 0.84 ALDH1A1 (0.50) EPHX2NR1H4ALDH1A1NAMPTKMT2A
SCHEMBL6404074 0.84 SMN1; SMN2 (0.51) ALDH1A1HTTKMT2AMEN1SMN1; SMN2
SCHEMBL6403892 0.83 LMNA (0.49) EPHX2ALDH1A1KMT2AMEN1TDP1
SCHEMBL6406614 0.83 NAMPT (0.48) EPHX2NAMPTKMT2AMEN1SMN1; SMN2
SCHEMBL6405551 0.83 KMT2A (0.41) EPHX2ALDH1A1NAMPTHTTKMT2A
SCHEMBL6405202 0.83 HSP90AA1 (0.47) ALDH1A1NAMPTHTTKMT2AMEN1
SCHEMBL6407737 0.82 HDAC6 (0.49) ALDH1A1KMT2AMEN1TDP1GAA
SCHEMBL6403585 0.82 SMN1; SMN2 (0.55) EPHX2NR1H4ALDH1A1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 US disclosed
US-6849717-B1 Polycystic kidney disease gene homologs required for male mating behavior in nematodes and assays based thereon CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-02-01 US disclosed
US-6723557-B1 PROVIDES A TOOL TO IDENTIFY THE GENES AND FACTORS INVOLVED IN THE POLYCYSTIC KIDNEY DISEASE PATHWAY, FOR DRUG SCREENING AND TREATMENT; LOCATION OF VULVA (LOV-1) GENE CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-04-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 EPHX2 2961/4885NR1H4 3774/4885ALDH1A1 1486/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.