SCHEMBL4648097

SCHEMBL4648097

COc1ccc(-c2ccnc(-n3c(=O)n(Cc4ccccc4)c4ccccc43)n2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.49
PDE4B Q07343 8/20 0.49
PDE4C Q08493 8/20 0.49
PDE4D Q08499 8/20 0.49
TSHR P16473 2/20 0.46
KMT2A Q03164 2/20 0.45
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
DYRK1A Q13627 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
KMO O15229 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL4642976 0.89 FAAH (0.42) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4642908 0.82 KMO (0.43) TSHRKMT2ASMN1; SMN2KMOKDM4E
SCHEMBL4642625 0.80 KDM4E (0.40) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4644221 0.78 KDM4E (0.46) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL4642768 0.78 MAP3K11 (0.50) TSHRSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL9650010 0.73 ADORA3 (0.52) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL4642920 0.73 PDE4D (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL4642937 0.73 PDE4D (0.50) PDE4APDE4BPDE4CPDE4DKMO
SCHEMBL4645355 0.70 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL4645167 0.69 PDE4D (0.44) PDE4APDE4BPDE4CPDE4DKMO

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-20080207659-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE 4 RANBAXY LABORATORIES LIMITED (IN) 2008-08-28 US claimed
EP-1958947-A1 Inhibitors of phosphodiesterase type 4 Ranbaxy Laboratories Limited (IN) 2008-08-20 EP claimed
US-20080207659-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE 4 RANBAXY LABORATORIES LIMITED (IN) 2008-08-28 US disclosed
EP-1958947-A1 Inhibitors of phosphodiesterase type 4 Ranbaxy Laboratories Limited (IN) 2008-08-20 EP 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-20080207659-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE 4 PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885

“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.