SCHEMBL13316993

SCHEMBL13316993

C=S(C)(=O)N(c1ccc([N+](=O)[O-])cc1O)S(C)(=O)=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.45
CYP19A1 P11511 11/20 0.44
ALDH1A1 P00352 4/20 0.41
TP53 P04637 2/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 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
SCHEMBL8662724 0.75 GPR35 (0.46) GPR35CYP19A1ALDH1A1TP53HPGD
SCHEMBL10876009 0.75 ALDH1A1 (0.63) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL2122702 0.73 CYP19A1 (0.48) CYP19A1ALDH1A1HTT
SCHEMBL594453 0.71 ALDH1A1 (0.55) CYP19A1ALDH1A1TSHRSMN1; SMN2L3MBTL1
SCHEMBL13514349 0.71 CYP19A1 (0.56) CYP19A1ALDH1A1HTT
SCHEMBL31738343 0.70 GPR35 (0.55) GPR35ALDH1A1TP53HPGDTSHR
SCHEMBL30204314 0.70 CYP19A1 (0.45) CYP19A1ALDH1A1TSHRL3MBTL1
SCHEMBL9022132 0.70 HSD17B10 (0.53) CYP19A1ALDH1A1SMN1; SMN2
SCHEMBL1678369 0.70 GPR35 (0.50) GPR35CYP19A1ALDH1A1TP53HPGD
SCHEMBL9488095 0.69 PTGS2 (0.41) GPR35CYP19A1ALDH1A1TP53L3MBTL1

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-7741520-B2 Sulfonanilide analogs as selective aromatase modulators (SAMs) THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2010-06-22 US disclosed
US-20080045598-A1 Novel sulfonanilide analogs as selective aromatase modulators (SAMs) THE OHIO STATE UNIVERSITY (US) 2008-02-21 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-20080045598-A1 Novel sulfonanilide analogs as selective aromatase modulators (SAMs) CYP19A1, AR, SULT2A1 GPR35 512/4885CYP19A1 1/4885ALDH1A1 122/4885

“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.