SCHEMBL4704762

SCHEMBL4704762

CCCCN(c1cccc(C(=O)C=CN(C)C)c1)S(=O)(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ ALOX5 P09917 3/20 0.50
▸ ALDH1A1 P00352 4/20 0.49
▸ MAPT P10636 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ NR1I2 O75469 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ RECQL P46063 1/20 0.48
▸ PTGES O14684 2/20 0.46
▸ HTT P42858 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.43
▸ RAB9A P51151 1/20 0.42
▸ P4HB P07237 2/20 0.41

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
SCHEMBL4704761 1.00 ESR1 (0.53) ESR1L3MBTL1ALOX5ALDH1A1MAPT
SCHEMBL4702502 0.94 ALDH1A1 (0.51) ESR1L3MBTL1ALOX5ALDH1A1MAPT
SCHEMBL4702500 0.94 ALDH1A1 (0.51) ESR1L3MBTL1ALOX5ALDH1A1MAPT
SCHEMBL4702684 0.89 BMP1 (0.48) ESR1L3MBTL1ALOX5ALDH1A1MAPT
SCHEMBL4702685 0.89 BMP1 (0.48) ESR1L3MBTL1ALOX5ALDH1A1MAPT
SCHEMBL1884750 0.89 ALDH1A1 (0.53) ESR1ALDH1A1MAPTGAANR1I2
SCHEMBL1884748 0.89 ALDH1A1 (0.53) ESR1ALDH1A1MAPTGAANR1I2
SCHEMBL1877681 0.88 MAPT (0.50) ESR1ALDH1A1MAPTGAASMN1; SMN2
SCHEMBL1877679 0.88 MAPT (0.50) ESR1ALDH1A1MAPTGAASMN1; SMN2
SCHEMBL1876859 0.87 MAPT (0.49) ESR1ALDH1A1MAPTGAASMN1; SMN2

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
EP-1648896-B1 7-SUBSTITUTED 3-NITRO-PYRAZOLO [1,5-A] PYRIMIDINES FERRER INT (ES) 2008-02-13 — — EP disclosed
US-20070043064-A1 7-Substituted 3-nitro-pyrazo[1,5-a] pyrimidines FERRER INTERNACIONAL S.A. (ES) 2007-02-22 — — US disclosed
EP-1648896-A1 7-SUBSTITUTED 3-NITRO-PYRAZOLO [1,5-A] PYRIMIDINES FERRER INTERNACIONAL, S.A. (ES) 2006-04-26 — — EP disclosed
WO-2005014596-A1 7-SUBSTITUTED 3-NITRO-PYRAZOLO `1,5-A! PYRIMIDINES FERRER INTERNACIONAL, S.A. (ES) 2005-02-17 — — 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-20070043064-A1 7-Substituted 3-nitro-pyrazo[1,5-a] pyrimidines GABRB1, GABRA1, GABRB2 ESR1 862/4885L3MBTL1 3930/4885ALOX5 1897/4885

“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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