SCHEMBL7359292

SCHEMBL7359292

COc1ccc2c(c1OC1CCCC1)CCN=C2Cc1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 0.48
PDE4D Q08499 10/20 0.48
PDE4B Q07343 8/20 0.48
PDE4C Q08493 7/20 0.48
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
Hydrochloric Acid SCHEMBL7989912 0.99 PDE4A (0.48) PDE4APDE4DPDE4BPDE4CKDM4E
SCHEMBL7388851 0.89 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CKDM4E
Hydrochloric Acid SCHEMBL7991157 0.81 PDE4B (0.67) PDE4APDE4DPDE4BPDE4C
SCHEMBL7361347 0.74 PDE4A (0.46) PDE4APDE4DPDE4BPDE4CALDH1A1
Hydrochloric Acid SCHEMBL7989915 0.69 PDE4A (0.47) PDE4APDE4DPDE4BPDE4C
SCHEMBL18183564 0.68 KDM4E (0.51) KDM4EALDH1A1LMNA
SCHEMBL4404454 0.67 PDE4A (0.63) PDE4APDE4DPDE4BPDE4C
SCHEMBL986245 0.66 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CKDM4E
SCHEMBL1157351 0.66 PDE4A (0.58) PDE4APDE4DPDE4BPDE4C
Hydrochloric Acid SCHEMBL8982808 0.66 KDM4E (0.42) KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060173-A2 BENZAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.p.A. (IT) 2000-12-20 EP disclosed
WO-1999032449-A2 BENZAZINE DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.P.A. (IT) 1999-07-01 WO disclosed