SCHEMBL10312362

SCHEMBL10312362

CN(CCCC(C)(C)C)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47
CCR5 P51681 1/20 0.45
ESR2 Q92731 1/20 0.44
NR1H3 Q13133 1/20 0.43
PTGES O14684 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
ESR1 P03372 1/20 0.40
GLA P06280 1/20 0.40
HSD11B1 P28845 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NR1I2 O75469 1/20 0.40
PDE4D Q08499 1/20 0.39
MAPK1 P28482 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
SCHEMBL10312363 0.85 MAPK1 (0.50) TDP1ESR2LMNAAPOBEC3GESR1
SCHEMBL10312389 0.84 KMT2A (0.51) ALDH1A1LMNAGAAKDM4EMAPT
SCHEMBL11184672 0.82 CCR5 (0.56) TDP1CCR5ESR2NR1H3PTGES
SCHEMBL5190090 0.81 TDP1 (0.71) TDP1CCR5ESR2PTGESALDH1A1
SCHEMBL10312373 0.81 ESR1 (0.57) LMNAESR1HSD11B1NR1I2MAPK1
SCHEMBL7017780 0.79 TDP1 (0.50) TDP1CCR5NR1H3PTGESALDH1A1
SCHEMBL3621820 0.79 TDP1 (0.50) TDP1CCR5NR1H3PTGESALDH1A1
SCHEMBL9278436 0.79 ESR2 (0.56) TDP1CCR5ESR2NR1H3ALDH1A1
SCHEMBL15677252 0.78 CNR2 (0.56) ALDH1A1MAPT
SCHEMBL8356647 0.78 TDP1 (0.62) TDP1CCR5PTGESESR1MAPT

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
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
US-7696177-B2 Anti-hypercholesterolemic compounds MERCK SHARP & DOHME CORP. (US) 2010-04-13 US disclosed
US-20100004184-A1 Anti-hypercholesterolemic compounds MERCK SHARP & DOHME CORP. 2010-01-07 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 (2 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-20100004184-A1 Anti-hypercholesterolemic compounds PCSK9, SLC10A1, NPC1 TDP1 4666/4885CCR5 3322/4885ESR2 773/4885
US-20120178261-A1 SILICON-CONTAINING COMPOSITION HAVING SULFONAMIDE GROUP FOR FORMING RESIST UNDERLAYER FILM STS, SI, MUS81 TDP1 2589/4885CCR5 4824/4885ESR2 3743/4885

“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.