SCHEMBL14775545

SCHEMBL14775545

Cc1nn(-c2ccccc2)c2sc(C(=O)Nc3ccc(N4CCCCC4)cc3)cc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.73
TP53 P04637 4/20 0.67
POLB P06746 2/20 0.65
HPGD P15428 4/20 0.65
ALDH1A1 P00352 3/20 0.65
LMNA P02545 2/20 0.65
NPSR1 Q6W5P4 2/20 0.65
USP2 O75604 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
CREBBP Q92793 1/20 0.65
KDM4E B2RXH2 2/20 0.63
GLA P06280 1/20 0.63
PKM P14618 1/20 0.63
TSHR P16473 1/20 0.63
NPC1 O15118 1/20 0.61
HTT P42858 1/20 0.61
RAB9A P51151 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
MEN1 O00255 1/20 0.61
HCRTR1 O43613 1/20 0.61

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
SCHEMBL854024 0.91 MAPT (0.72) MAPTTP53POLBHPGDALDH1A1
SCHEMBL14775914 0.91 MAPT (0.72) MAPTTP53POLBHPGDALDH1A1
SCHEMBL855145 0.91 MAPT (0.72) MAPTTP53POLBHPGDALDH1A1
SCHEMBL854849 0.90 MAPT (0.71) MAPTTP53POLBHPGDALDH1A1
SCHEMBL853289 0.90 MAPT (0.71) MAPTTP53POLBHPGDALDH1A1
SCHEMBL853067 0.90 MAPT (0.69) MAPTTP53POLBHPGDALDH1A1
SCHEMBL853735 0.90 PDE7A (0.70) MAPTTP53POLBHPGDALDH1A1
SCHEMBL853800 0.88 MAPT (0.85) MAPTTP53POLBHPGDALDH1A1
SCHEMBL853125 0.86 PDE7A (0.71) MAPTTP53POLBHPGDALDH1A1
SCHEMBL854483 0.86 MAPT (0.82) MAPTTP53POLBHPGDALDH1A1

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