SCHEMBL3376788

SCHEMBL3376788

Cc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 3/20 0.78
▸ CRHR2 Q13324 3/20 0.78
▸ HSP90AA1 P07900 2/20 0.64
▸ CYP19A1 P11511 1/20 0.58
▸ ALDH1A1 P00352 5/20 0.57
▸ LMNA P02545 4/20 0.57
▸ TDP1 Q9NUW8 2/20 0.57
▸ NHERF1 O14745 1/20 0.55
▸ MAPT P10636 5/20 0.54
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ HTT P42858 3/20 0.53
▸ PKM P14618 3/20 0.53
▸ GAA P10253 1/20 0.52
▸ MCL1 Q07820 1/20 0.52
▸ POLB P06746 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ RAB9A P51151 1/20 0.50
▸ KEAP1 Q14145 1/20 0.50

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
SCHEMBL11932410 0.89 CRHBP (0.61) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1
SCHEMBL8309888 0.87 CRHBP (1.00) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1
SCHEMBL6368961 0.87 CRHBP (0.68) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1
SCHEMBL9515445 0.87 CRHBP (0.74) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1
SCHEMBL11740810 0.86 CRHBP (0.67) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1
SCHEMBL10531035 0.84 CRHBP (0.75) CRHBPCRHR2HSP90AA1ALDH1A1LMNA
SCHEMBL397429 0.84 CRHBP (0.67) CRHBPCRHR2HSP90AA1ALDH1A1NHERF1
SCHEMBL30680186 0.84 CRHBP (0.67) CRHBPCRHR2HSP90AA1ALDH1A1NHERF1
SCHEMBL10825507 0.84 MCL1 (0.60) CRHBPCRHR2HSP90AA1ALDH1A1LMNA
SCHEMBL28728720 0.84 CRHBP (0.61) CRHBPCRHR2HSP90AA1CYP19A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-06-24 — — US disclosed
EP-1844768-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-10-17 — — EP disclosed
US-20040023938-A1 Sulfonamide derivatives TABUCHI TAKANORI (JP) 2004-02-05 — — US disclosed
US-6586617-B1 Nontoxic microbiocides such as 4'-chloro-N-ethyl-2'-nitro-p-toluenesulfonanilide, for agricultural or horticultural, prepared by alkylation or nitration SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2003-07-01 — — US disclosed
EP-1174028-A1 SULFONAMIDE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2002-01-23 — — EP 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-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR NR3C2, AGTR1, AGTR2 CRHBP 1267/4885CRHR2 67/4885HSP90AA1 2809/4885
US-20040023938-A1 Sulfonamide derivatives FPR1, MRM1, SULT1E1 CRHBP 3949/4885CRHR2 1602/4885HSP90AA1 2006/4885

“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.

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