SCHEMBL1715967

SCHEMBL1715967

N#Cc1ccc(S(=O)(=O)NCCCON)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.55
LSS P48449 2/20 0.47
MAPK1 P28482 1/20 0.47
ALDH1A1 P00352 6/20 0.46
GAA P10253 1/20 0.46
PKM P14618 3/20 0.45
TRPV4 Q9HBA0 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1714909 0.91 CYP19A1 (0.58) CYP19A1LSSALDH1A1TRPV4MEN1
SCHEMBL17623715 0.83 CYP19A1 (0.59) CYP19A1LSSALDH1A1PKMTRPV4
SCHEMBL22558321 0.80 CYP19A1 (0.59) CYP19A1LSSALDH1A1GAAPKM
SCHEMBL3120110 0.80 CYP19A1 (0.59) CYP19A1LSSALDH1A1GAAPKM
SCHEMBL1716129 0.80 MAPK1 (0.71) MAPK1ALDH1A1GAAPKMMEN1
SCHEMBL8486102 0.77 MEN1 (0.58) CYP19A1ALDH1A1PKMMEN1KMT2A
SCHEMBL8066199 0.77 LSS (0.56) CYP19A1LSSALDH1A1PKMMEN1
SCHEMBL2064469 0.76 CYP19A1 (0.63) CYP19A1LSSALDH1A1GAAPKM
SCHEMBL3119830 0.76 CYP19A1 (0.63) CYP19A1LSSTRPV4
SCHEMBL5366125 0.76 CYP19A1 (0.63) CYP19A1LSSALDH1A1PKMTRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US claimed
JP-2007513098-A 2007-05-24 JP claimed
EP-1697312-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2006-09-06 EP claimed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 WO claimed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 EP disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US disclosed
EP-1697312-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF Leo Pharma A/S (DK) 2006-09-06 EP disclosed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 WO 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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 CYP19A1 927/4885LSS 2879/4885MAPK1 4401/4885

“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.