SCHEMBL6512246

SCHEMBL6512246

COc1ccc(C(Cc2ccncc2)c2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 17/20 0.66
PDE4D Q08499 2/20 0.65
PDE4B Q07343 1/20 0.65
PDE4C Q08493 1/20 0.65
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KDM4E B2RXH2 1/20 0.51
USP2 O75604 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
TSHR P16473 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL6512242 1.00 PDE4A (0.66) PDE4APDE4DPDE4BPDE4CSLC6A2
SCHEMBL8925196 0.90 PDE4A (0.74) PDE4APDE4DPDE4BPDE4CSLC6A2
SCHEMBL7925777 0.85 PDE4A (0.60) PDE4APDE4DPDE4BPDE4C
SCHEMBL7675692 0.85 PDE4A (0.60) PDE4APDE4DPDE4BPDE4C
SCHEMBL6512654 0.84 PDE4A (0.67) PDE4APDE4DPDE4BPDE4C
SCHEMBL6512648 0.84 PDE4A (0.67) PDE4APDE4DPDE4BPDE4C
SCHEMBL6886847 0.81 PDE4A (0.86) PDE4APDE4DPDE4BPDE4C
SCHEMBL6886848 0.81 PDE4A (0.86) PDE4APDE4DPDE4BPDE4C
SCHEMBL6509812 0.81 PDE4A (0.63) PDE4APDE4DPDE4BPDE4CSLC6A2
SCHEMBL6509817 0.81 PDE4A (0.63) PDE4APDE4DPDE4BPDE4CSLC6A2

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
EP-0766669-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH R&D LTD (GB) 2005-04-20 EP disclosed
US-20020143011-A1 Tri-substituted phenyl derivatives and processes for their preparation CELLTECH THERAPEUTICS, LIMITED 2002-10-03 US disclosed
US-6245774-B1 ANTIINFLAMMATORY AGENTS; BRONCHODILATOR AGENTS CELLTECH THERAPEUTICS LIMITED (GB) 2001-06-12 US disclosed
EP-0766669-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1997-04-09 EP disclosed
WO-1995035283-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1995-12-28 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-20020143011-A1 Tri-substituted phenyl derivatives and processes for their preparation CBR1, NCOR1, CNR1 PDE4A 4775/4885PDE4D 4857/4885PDE4B 4371/4885

“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.