SCHEMBL7376963

SCHEMBL7376963

CCOc1ccc(CO)cc1OC1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
PDE4B Q07343 6/20 0.49
PDE3A Q14432 1/20 0.49
RECQL P46063 1/20 0.48
POLB P06746 2/20 0.48
PDE4A P27815 4/20 0.45
PDE4C Q08493 4/20 0.45
PDE4D Q08499 4/20 0.45
PDE7A Q13946 1/20 0.45
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CSNK2A1 P68400 2/20 0.44
LMNA P02545 1/20 0.43
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
ALPG P10696 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43

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
SCHEMBL8846224 0.88 RECQL (0.55) PDE4BRECQLPOLBPDE4APDE4C
SCHEMBL2958828 0.85 RECQL (0.60) PDE4BRECQLPOLBPDE4APDE4C
SCHEMBL134754 0.82 RECQL (0.67) PDE4BRECQLPOLBPDE4APDE4C
SCHEMBL7925327 0.82 RECQL (0.48) HTTPDE4BPDE3ARECQLPDE4A
SCHEMBL697888 0.81 HTT (0.61) HTTPDE3APOLBPDE4APDE4D
SCHEMBL6812898 0.79 PDE4D (0.56) PDE4BRECQLPDE4APDE4CPDE4D
SCHEMBL682485 0.79 POLB (0.57) PDE4BPDE3APOLBPDE4APDE4C
SCHEMBL7940494 0.78 RECQL (0.43) HTTPDE4BPDE3ARECQLPOLB
SCHEMBL16952573 0.77 HTT (0.49) HTTALDH1A1CYP1A2MAPTCYP2C9
SCHEMBL15904183 0.77 CSNK2A1 (0.48) PDE4BRECQLPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796093-A4 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO CELTIQUE SA (LU) 1998-05-13 EP disclosed
EP-0796093-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV Euroceltique S.A. (LU) 1997-09-24 EP disclosed
WO-1996021435-A1 COMPOUNDS FOR AND METHOD OF INHIBITING PHOSPHODIESTERASE IV EURO-CELTIQUE, S.A. (LU) 1996-07-18 WO disclosed