SCHEMBL8619735

SCHEMBL8619735

Cc1ccccc1-c1cc(NC(=N)NC=O)c2c(OC3CCCC3)cccc2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.35
PDE4D Q08499 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4C Q08493 1/20 0.35
F10 P00742 4/20 0.35
PLG P00747 4/20 0.35
PLAU P00749 4/20 0.35
PLAT P00750 4/20 0.35
F2 P00734 3/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
ACP1 P24666 3/20 0.34
DNMT1 P26358 1/20 0.34
EHMT2 Q96KQ7 1/20 0.34
EPHX2 P34913 1/20 0.33
ABL1 P00519 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL8619913 0.86 TGFBR1 (0.39) MEN1POLBKMT2AACP1KDM4E
SCHEMBL8618132 0.84 DNMT1 (0.36) MEN1POLBKMT2AACP1DNMT1
SCHEMBL8620877 0.84 HTT (0.39) MEN1POLBKMT2AACP1KDM4E
SCHEMBL8615489 0.84 KCNH2 (0.35) MEN1POLBKMT2AACP1KDM4E
SCHEMBL8615341 0.84 MEN1 (0.39) MEN1KMT2AABL1KDM4EALDH1A1
SCHEMBL8620868 0.83 ACP1 (0.42) PDE4BPDE4DPDE4APDE4CF10
SCHEMBL8617721 0.82 CA2 (0.38) MEN1POLBKMT2AACP1DNMT1
SCHEMBL8613232 0.82 TACR3 (0.36) MEN1POLBKMT2AACP1DNMT1
SCHEMBL8619973 0.82 TACR3 (0.34) MEN1POLBKMT2AACP1KDM4E
SCHEMBL8618522 0.82 ABL1 (0.36) MEN1KMT2ADNMT1EHMT2ABL1

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-0726254-B1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS (JP) 1998-05-06 EP disclosed
US-5627193-A MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-06 US disclosed
EP-0726254-A1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-08-14 EP disclosed