SCHEMBL4828083

SCHEMBL4828083

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Sc2ccc3nonc3c2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ATM Q13315 1/20 0.43
NPC1 O15118 2/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 1/20 0.39
EPHX2 P34913 1/20 0.37
NR1H4 Q96RI1 1/20 0.37
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL4828079 0.88 POLB (0.42) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL14193556 0.87 SMN1; SMN2 (0.54) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4825914 0.85 POLB (0.44) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4830151 0.83 PDE2A (0.41) POLBLMNASMN1; SMN2NPC1KMT2A
SCHEMBL4831852 0.83 ATM (0.42) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4828112 0.82 PDE4A (0.53) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL4821966 0.80 POLB (0.45) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4830184 0.76 POLB (0.42) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4831847 0.75 POLB (0.40) POLBLMNASMN1; SMN2ATMNPC1
SCHEMBL4830170 0.75 POLB (0.54) POLBLMNASMN1; SMN2ATMNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186989-A1 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of pde4 isozymes PFIZER INC. 2003-10-02 US claimed
EP-1252158-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES Pfizer Products Inc. (US) 2002-10-30 EP claimed
WO-2001057036-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2001-08-09 WO claimed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
US-7354941-B2 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of PDE4 isozymes PFIZER PRODUCTS INC. (US) 2008-04-08 US disclosed
EP-1252158-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES Pfizer Products Inc. (US) 2002-10-30 EP disclosed
WO-2001057036-A1 NICOTINAMIDE BENZOFUSED-HETEROCYCLYL DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF PDE4 ISOZYMES PFIZER PRODUCTS INC. (US) 2001-08-09 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-20030186989-A1 Nicotinamide benzofused-heterocyclyl derivatives useful as selective inhibitors of pde4 isozymes PDE4B, PDE4A, NOX4 POLB 2221/4885LMNA 4406/4885SMN1; SMN2 1930/4885

“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.