SCHEMBL10300192

SCHEMBL10300192

COc1ccccc1N(CCO)S(=O)(=O)c1ccc(Cl)c(N)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.49
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALPL P05186 1/20 0.45
ALPI P09923 1/20 0.45
ALPG P10696 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
PKM P14618 2/20 0.43
HPGD P15428 1/20 0.43
HCRTR2 O43614 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
SCHEMBL10300191 0.90 L3MBTL1 (0.54) ESR1MAPTLMNAKDM4EKMT2A
SCHEMBL10300189 0.87 ESR1 (0.62) ESR1MAPTLMNAKDM4EKMT2A
SCHEMBL10300184 0.82 KMT2A (0.59) LMNAKDM4EKMT2AALDH1A1SMN1; SMN2
SCHEMBL10300190 0.80 KMT2A (0.44) ESR1MAPTLMNAKMT2AMEN1
SCHEMBL8712282 0.79 ESR1 (0.60) ESR1LMNAKMT2ASMN1; SMN2L3MBTL1
SCHEMBL8710952 0.79 ESR1 (0.60) ESR1MAPTLMNAKMT2AMEN1
SCHEMBL11686046 0.75 VCAM1 (0.63) MAPTLMNAKDM4EKMT2AALDH1A1
SCHEMBL10300211 0.71 ESR1 (0.52) ESR1MAPTLMNAKDM4EKMT2A
SCHEMBL5467456 0.70 ALDH1A1 (0.60) ESR1MAPTLMNAKDM4EKMT2A
SCHEMBL10300185 0.70 C5AR1 (0.47) ESR1MAPTKDM4EKMT2AMEN1

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-8217069-B2 Nitrogenated fused ring derivative, pharmaceutical composition comprising the same, and use of the same for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-07-10 US disclosed
US-8217069-B2 Nitrogenated fused ring derivative, pharmaceutical composition comprising the same, and use of the same for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-07-10 US disclosed
US-20100112090-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD (JP) 2010-05-06 US disclosed
US-20100112090-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD (JP) 2010-05-06 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-20100112090-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES NR5A1, SHBG, GNRHR ESR1 35/4885MAPT 4731/4885LMNA 4373/4885

“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.