SCHEMBL2859459

SCHEMBL2859459

CCCn1ncc2c(Nc3cccc(C(=O)N4CCN(c5ccccc5)CC4)c3)nc(N3CCCC3)nc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.49
PIK3CA P42336 2/20 0.47
MAPK14 Q16539 2/20 0.45
ABL1 P00519 1/20 0.45
SRC P12931 1/20 0.45
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
CAMK1D Q8IU85 2/20 0.42
GBA1 P04062 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MGLL Q99685 1/20 0.41
SCN9A Q15858 1/20 0.41

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
SCHEMBL2786916 0.93 PIK3CA (0.51) HTR2CPIK3CAMAPK14ABL1SRC
SCHEMBL2878746 0.90 HTR2C (0.61) HTR2CPIK3CAMAPK14GBA1
SCHEMBL2856457 0.85 PIK3CA (0.52) HTR2CPIK3CAMAPK14ABL1SRC
SCHEMBL2807570 0.79 PIK3CA (0.56) HTR2CPIK3CAABL1SRCNPC1
SCHEMBL2882852 0.75 HTR2C (0.61) HTR2CPIK3CAABL1SRC
SCHEMBL2788332 0.74 PIK3CA (0.55) HTR2CPIK3CAABL1SRCMAPT
SCHEMBL2878573 0.74 PIK3CA (0.62) HTR2CPIK3CAMAPTLMNAMAPK1
SCHEMBL2808009 0.73 HTR2C (0.60) HTR2C
SCHEMBL2807943 0.71 SRC (0.68) HTR2CPIK3CAABL1SRCUSP2
SCHEMBL2788589 0.71 SRC (0.68) HTR2CPIK3CAABL1SRCMAPT

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
WO-2010118367-A2 ANTIVIRAL PYRIMIDINES PROGENICS PHARMACEUTICALS, INC. (US) 2010-10-14 WO disclosed