SCHEMBL5492932

SCHEMBL5492932

COc1cc2c(cc1OC)N(Cc1ccccc1)C(=O)CN=C2c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.60
PTGDR2 Q9Y5Y4 6/20 0.57
NPSR1 Q6W5P4 2/20 0.57
GAA P10253 2/20 0.57
HTT P42858 1/20 0.57
GPR55 Q9Y2T6 1/20 0.57
MAPT P10636 1/20 0.53
TSHR P16473 1/20 0.52
LMNA P02545 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL4708303 0.89 TP53 (0.52) TP53PTGDR2NPSR1GAAHTT
SCHEMBL5490309 0.89 TP53 (0.58) TP53PTGDR2NPSR1GAAHTT
SCHEMBL5489965 0.88 TP53 (0.52) TP53NPSR1GAAHTTGPR55
SCHEMBL4710191 0.88 NPSR1 (0.58) TP53PTGDR2NPSR1GAAHTT
SCHEMBL4707864 0.87 PDE2A (0.67) TP53PTGDR2NPSR1GAAHTT
SCHEMBL5490657 0.86 TP53 (0.51) TP53MAPTLMNA
SCHEMBL5484931 0.86 TP53 (0.51) TP53NPSR1GAAHTTGPR55
SCHEMBL5491336 0.86 PTGDR2 (0.54) TP53PTGDR2NPSR1GAAHTT
SCHEMBL5493500 0.85 PDE2A (0.54) TP53MAPTLMNA
SCHEMBL5490400 0.85 PTGDR2 (0.47) TP53PTGDR2NPSR1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US claimed
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 TP53 4880/4885PTGDR2 135/4885NPSR1 154/4885

“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.