SCHEMBL1389103

SCHEMBL1389103

COc1ccc(/C=C(/C#N)c2cccs2)cc1OC1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.50
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HIF1A Q16665 1/20 0.44
EGFR P00533 1/20 0.44
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
MAPT P10636 3/20 0.44
TP53 P04637 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
THRB P10828 1/20 0.43
KDM4E B2RXH2 1/20 0.43
QRFPR Q96P65 1/20 0.43
PDE3A Q14432 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
SCHEMBL8770151 1.00 PDE4B (0.50) PDE4BRECQLSMN1; SMN2HIF1AEGFR
SCHEMBL1389104 1.00 PDE4B (0.50) PDE4BRECQLSMN1; SMN2HIF1AEGFR
SCHEMBL1958419 0.87 MAPT (0.56) RECQLSMN1; SMN2HIF1AEGFRPDGFRB
SCHEMBL1958420 0.87 MAPT (0.56) RECQLSMN1; SMN2HIF1AEGFRPDGFRB
SCHEMBL1958418 0.87 MAPT (0.56) RECQLSMN1; SMN2HIF1AEGFRPDGFRB
SCHEMBL8482808 0.84 SMN1; SMN2 (0.57) PDE4BRECQLSMN1; SMN2HIF1AEGFR
SCHEMBL8482805 0.84 SMN1; SMN2 (0.57) PDE4BRECQLSMN1; SMN2HIF1AEGFR
SCHEMBL6609676 0.83 PDE4B (0.44) PDE4BALDH1A1QRFPRPDE4APDE4C
SCHEMBL6609672 0.83 PDE4B (0.44) PDE4BALDH1A1QRFPRPDE4APDE4C
SCHEMBL7358568 0.82 RECQL (0.57) PDE4BRECQLSMN1; SMN2HIF1AEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640070-B1 STYRYL DERIVATIVES, THEIR PREPARATION AND USE AS PDE-IV INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 1997-09-10 EP claimed
JP-H08501801-A 1996-02-27 JP claimed
EP-0640070-A1 STYRYL DERIVATIVES, THEIR PREPARATION AND USE AS PDE-IV INHIBITORS. CELLTECH THERAPEUTICS LTD (GB) 1995-03-01 EP claimed
WO-1994020455-A1 STYRYL DERIVATIVES, THEIR PREPARATION AND USE AS PDE-IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1994-09-15 WO claimed
EP-0640070-B1 STYRYL DERIVATIVES, THEIR PREPARATION AND USE AS PDE-IV INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 1997-09-10 EP disclosed
US-5633257-A PHOSPHODIESTERASE INHIBITOR CELLTECH THERAPEUTICS LIMITED (GB) 1997-05-27 US disclosed