SCHEMBL9601585

SCHEMBL9601585

O=C1CC2CSc3ccccc3C2=NN1c1ccc(O)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.36
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
PRKCZ Q05513 2/20 0.32
HIF1A Q16665 1/20 0.32
POLB P06746 1/20 0.32
MAP3K7 O43318 1/20 0.32
TAB1 Q15750 1/20 0.32
NR1H3 Q13133 1/20 0.32
MAOB P27338 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31

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
SCHEMBL10562323 0.90 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL10562924 0.89 CES2 (0.36) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL10560355 0.89 HTT (0.38) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7289330 0.88 MIF (0.34) MIFPDE4APDE4BPDE4CPDE4D
SCHEMBL10561260 0.88 ACHE (0.36) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL10557556 0.88 MAPT (0.39) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL8580740 0.88 GABRP (0.43) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL9602523 0.87 MEN1 (0.38) MIFPDE4APDE4BPDE4CPDE4D
SCHEMBL10564538 0.86 IDO1 (0.36) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL10561829 0.85 MAPT (0.42) PDE4APDE4BPDE4CPDE4DPOLB

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-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 US disclosed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 EP disclosed