SCHEMBL5491406

SCHEMBL5491406

COc1cc2c(cc1OC)C(=O)NN(C)C(=O)C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
BRD4 O60885 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP3A4 P08684 3/20 0.41
MAPT P10636 1/20 0.41
ACHE P22303 2/20 0.41
CHEK1 O14757 1/20 0.39
MAPK1 P28482 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
APP P05067 1/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL3560449 0.73 TDP2 (0.57) CYP3A4MAPTACHEMAPK1CYP1A2
SCHEMBL5493409 0.73 GAA (0.47) GAASMN1; SMN2BRD4MEN1KMT2A
SCHEMBL5484434 0.72 CYP3A4 (0.47) MEN1KMT2ACYP3A4MAPTACHE
SCHEMBL31369146 0.70 CYP3A4 (0.62) MEN1KMT2ACYP3A4MAPTACHE
SCHEMBL16156009 0.70 CYP3A4 (0.56) GAASMN1; SMN2MEN1KMT2ACYP3A4
SCHEMBL5494625 0.70 GAA (0.47) GAASMN1; SMN2BRD4MEN1KMT2A
SCHEMBL10200127 0.69 CYP3A4 (0.49) MEN1KMT2ACYP3A4MAPTACHE
SCHEMBL7981630 0.69 MAPT (0.75) GAAMEN1KMT2ACYP3A4MAPT
SCHEMBL1512496 0.69 CYP3A4 (0.54) GAAMEN1KMT2ACYP3A4MAPT
SCHEMBL30882012 0.67 PARP10 (0.53) MEN1KMT2ACYP3A4

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-7250410-B2 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof VIA PHARMACEUTICALS, INC. (US) 2007-07-31 US disclosed
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US disclosed
EP-1392663-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2004-03-03 EP disclosed
WO-2002098865-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2002-12-12 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-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof PDE7A, PDE3B, PDE3A GAA 266/4885SMN1; SMN2 2918/4885BRD4 2027/4885

“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.