SCHEMBL7603613

SCHEMBL7603613

COc1ccc(-c2ccc(C(=O)O)cc2)cc1-c1cccc(C#N)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.55
RARB P10826 1/20 0.55
RARG P13631 1/20 0.55
STK10 O94804 1/20 0.52
SLK Q9H2G2 1/20 0.52
ACLY P53396 2/20 0.50
HPSE Q9Y251 1/20 0.49
PTGDR2 Q9Y5Y4 2/20 0.49
XDH P47989 1/20 0.49
SLC22A12 Q96S37 1/20 0.49
CTSA P10619 2/20 0.46
KIT P10721 1/20 0.46
PDE4A P27815 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
PLAU P00749 1/20 0.45
P4HB P07237 1/20 0.45
PDE4B Q07343 1/20 0.45

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
SCHEMBL2037082 0.84 KDM1A (0.55) RARARARBRARGPTGDR2XDH
SCHEMBL29788150 0.84 XDH (0.65) XDHSLC22A12PDE4APDE4CPDE4D
SCHEMBL2034067 0.84 XDH (0.65) XDHSLC22A12PDE4APDE4CPDE4D
SCHEMBL28788990 0.84 ROCK2 (0.51) STK10SLKHPSEPTGDR2XDH
SCHEMBL7553675 0.81 RARA (0.58) RARARARBRARGACLYHPSE
SCHEMBL7607470 0.81 KIT (0.51) STK10SLKACLYCTSAKIT
SCHEMBL2744330 0.79 LMNA (0.54) RARARARBRARGPTGDR2SLC22A12
SCHEMBL3138892 0.78 SLC22A12 (0.66) STK10SLKACLYHPSEXDH
SCHEMBL7449464 0.77 MEN1 (0.57) RARARARBRARGPDE4APDE4C
SCHEMBL17779981 0.77 P4HB (0.44) HPSEPTGDR2CTSAKITPDE4D

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-20020028831-A1 Phenylpyridine derivatives useful as phosphodiesterase inhibitors MANLEY PAUL W (CH) 2002-03-07 US claimed
US-6258843-B1 DRUGS AS ENZYME INHIBITORS NOVARTIS AG (CH) 2001-07-10 US claimed
EP-0885193-A1 TRIARYL COMPOUNDS Novartis AG (CH) 1998-12-23 EP claimed
WO-1997032853-A1 TRIARYL COMPOUNDS NOVARTIS AG (CH) 1997-09-12 WO claimed
US-6410547-B1 (4-OXY-3-(ARYL)PHENYL)PYRIDINE FOR TREATMENT, PROPHYLAXIS OF INFLAMMATION, ESP. INFLAMMATORY OR OBSTRUCTIVE DISEASES OF THE AIRWAYS, E.G. FOR ASTHMA THERAPY; INHIBITORS OF PDE 4 ISOENZYME; DOWN REGULATE OR INHIBIT TNF-ALPHA RELEASE NOVARTIS AG (CH) 2002-06-25 US disclosed
US-20020028831-A1 Phenylpyridine derivatives useful as phosphodiesterase inhibitors MANLEY PAUL W (CH) 2002-03-07 US disclosed
US-6288092-B1 BIPHENYL PYRIDINES, BENZAMIDES AND PENYLCARBOXY COMPOUNDS USED AS SELECTIVE INHIBITORS OF PHOSPHODIESTERASE 4 ISOENZYME ACTIVITY AND DOWN REGULATORS OR INHIBIT TUMOR NECROSIS FACTOR RELEASE; ANTIHISTAMINES AND ANTIINFLAMMATORY NOVARTIS AG (CH) 2001-09-11 US disclosed
US-6258843-B1 DRUGS AS ENZYME INHIBITORS NOVARTIS AG (CH) 2001-07-10 US disclosed
US-6090817-A Phenylpyridine derivatives useful as phosphodiesterase inhibitors NOVARTIS AG (CH) 2000-07-18 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-20020028831-A1 Phenylpyridine derivatives useful as phosphodiesterase inhibitors PDE4A, PDE4B, PDE12 RARA 1743/4885RARB 1083/4885RARG 1928/4885

“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.