SCHEMBL10312366

SCHEMBL10312366

CC(C)(C)CCCN(c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.41
ESR1 P03372 6/20 0.40
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL21708234 0.83 LMNA (0.43) KMT2AESR1CA12CA1CA9
SCHEMBL10312373 0.77 ESR1 (0.57) KMT2AESR1LMNA
SCHEMBL10312367 0.76 KMT2A (0.52) KMT2AMEN1CA12CA1CA9
SCHEMBL10312363 0.72 MAPK1 (0.50) KMT2AESR1CA12CA1CA9
SCHEMBL10312362 0.71 TDP1 (0.47) ESR1TDP1LMNA
SCHEMBL21834596 0.71 POLB (0.56) KMT2AMEN1
SCHEMBL15638649 0.70 KIF18A (0.54) KMT2AMEN1ESR1PSEN1PSEN2
SCHEMBL21708237 0.69 POLB (0.52) KMT2AMEN1LMNA
SCHEMBL11458445 0.68 MEN1 (0.46) KMT2AMEN1ESR1CA12CA1
SCHEMBL15677252 0.67 CNR2 (0.56) KMT2AMEN1

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-8828879-B2 Silicon-containing composition having sulfonamide group for forming resist underlayer film NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-09-09 US disclosed
US-20120178261-A1 SILICON-CONTAINING COMPOSITION HAVING SULFONAMIDE GROUP FOR FORMING RESIST UNDERLAYER FILM NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-07-12 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-20120178261-A1 SILICON-CONTAINING COMPOSITION HAVING SULFONAMIDE GROUP FOR FORMING RESIST UNDERLAYER FILM STS, SI, MUS81 KMT2A 23/4885MEN1 1321/4885ESR1 2543/4885

“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.