SCHEMBL6479557

SCHEMBL6479557

O=C(O)c1cccnc1S(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
RAB9A P51151 2/20 0.54
MEN1 O00255 2/20 0.54
NAPRT Q6XQN6 2/20 0.53
KDM4E B2RXH2 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 5/20 0.50
ALOX15 P16050 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
BLM P54132 1/20 0.50
AGER Q15109 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
DHODH Q02127 1/20 0.46
MYC P01106 1/20 0.45
HTR6 P50406 1/20 0.43

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
SCHEMBL2906040 0.82 RORB (0.48) KMT2ARAB9AMEN1ALDH1A1MAPT
SCHEMBL4015639 0.80 HTR2A (0.51) KMT2AMEN1NAPRTDHODH
SCHEMBL4015634 0.80 HTR2A (0.51) KMT2AMEN1NAPRTDHODH
SCHEMBL21449055 0.80 KDM4E (0.57) KMT2ARAB9AMEN1NAPRTKDM4E
SCHEMBL9826240 0.79 LMNA (0.56) KMT2ARAB9AMEN1NAPRTKDM4E
SCHEMBL31368527 0.79 KDM4E (0.55) KMT2ARAB9ANAPRTKDM4ETDP1
SCHEMBL5151972 0.79 NAPRT (0.56) RAB9ANAPRTKDM4ETDP1ALDH1A1
SCHEMBL28212024 0.77 KMT2A (0.58) KMT2ARAB9AMEN1TSHRHTR6
SCHEMBL1599379 0.75 KMT2A (0.57) KMT2ARAB9AMEN1KDM4ETDP1
SCHEMBL17362324 0.75 KMT2A (0.57) KMT2ARAB9AMEN1KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6953810-B2 Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes PFIZER INC (US) 2005-10-11 US disclosed
CN-1518542-A Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes �Ʒ� 2004-08-04 CN disclosed
US-20040048903-A1 Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes PFIZER INC. 2004-03-11 US disclosed
US-6649633-B2 For treatment of diseases regulated by the activation and degranulation of eosinophils, especially asthma, chronic bronchitis, and chronic obstructuive pulmonary disease PFIZER INC 2003-11-18 US disclosed
EP-1355884-A1 NICOTINAMIDE BIARYL DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES Pfizer Products Inc. (US) 2003-10-29 EP disclosed
US-20020193612-A1 Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes PFIZER INC. 2002-12-19 US disclosed
WO-2002060875-A1 NICOTINAMIDE BIARYL DERIVATIVES USEFUL AS INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2002-08-08 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 (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-20020193612-A1 Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes CBR1, CBR3, NOX1 KMT2A 2779/4885RAB9A 1429/4885MEN1 4687/4885
US-20040048903-A1 Nicotinamide biaryl derivatives useful as inhibitors of PDE4 isozymes CBR1, CBR3, NOX1 KMT2A 2854/4885RAB9A 1373/4885MEN1 4674/4885

“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.