SCHEMBL14775540

SCHEMBL14775540

Cc1nn(-c2ccccc2)c2sc(C(=O)Nc3ccc(N4CCC(C)CC4)c(Cl)c3)cc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.65
TP53 P04637 4/20 0.65
PDE7A Q13946 5/20 0.62
POLB P06746 1/20 0.60
NPC1 O15118 1/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 1/20 0.58
HPGD P15428 3/20 0.56
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 3/20 0.56
LMNA P02545 1/20 0.56
GLA P06280 1/20 0.56
PKM P14618 1/20 0.56
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
RNASEL Q05823 1/20 0.56
MEN1 O00255 1/20 0.54
HCRTR1 O43613 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL853713 0.93 PDE7A (0.71) MAPTTP53PDE7APOLBNPC1
SCHEMBL853816 0.92 PDE7A (0.72) MAPTTP53PDE7APOLBNPC1
SCHEMBL14775750 0.91 PDE7A (0.62) MAPTTP53PDE7APOLBNPC1
SCHEMBL853253 0.90 PDE7A (0.68) MAPTTP53PDE7APOLBNPC1
SCHEMBL853198 0.90 MAPT (0.60) MAPTTP53PDE7APOLBNPC1
SCHEMBL852726 0.89 MAPT (0.66) MAPTTP53PDE7APOLBNPC1
SCHEMBL853087 0.85 PDE7A (0.71) MAPTTP53PDE7APOLBNPC1
SCHEMBL852915 0.85 MAPT (0.63) MAPTTP53PDE7APOLBNPC1
SCHEMBL853907 0.84 PDE7A (0.73) MAPTTP53PDE7APOLBNPC1
SCHEMBL853869 0.84 PDE7A (0.71) MAPTTP53PDE7APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1775298-B1 THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY DAIICHI SANKYO CO LTD (JP) 2013-03-20 EP claimed