SCHEMBL6265665

SCHEMBL6265665

Cc1ccc(-n2ncc3c(C(N)c4ccc(Cl)c(Cl)c4)ncnc32)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.54
PIP4K2A P48426 3/20 0.53
LMNA P02545 6/20 0.50
HTT P42858 4/20 0.50
KDM4E B2RXH2 3/20 0.50
FSCN1 Q16658 1/20 0.50
NPC1 O15118 1/20 0.50
PKM P14618 1/20 0.50
MAPT P10636 5/20 0.49
TP53 P04637 3/20 0.49
HPGD P15428 5/20 0.48
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
HIF1A Q16665 1/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NTSR1 P30989 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALPL P05186 1/20 0.46

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
SCHEMBL6265668 0.74 LMNA (0.59) RAB9APIP4K2ALMNAHTTKDM4E
SCHEMBL6263777 0.74 RAB9A (0.70) RAB9APIP4K2ALMNAHTTKDM4E
SCHEMBL6265666 0.73 PIP4K2A (0.57) RAB9APIP4K2ALMNAHTTKDM4E
SCHEMBL6271125 0.68 MAPT (0.82) RAB9APIP4K2ALMNAKDM4EMAPT
SCHEMBL30723333 0.67 FSCN1 (1.00) LMNAHTTKDM4EFSCN1MAPT
SCHEMBL6264348 0.67 PIP4K2A (0.76) PIP4K2ALMNAKDM4EMAPTTP53
SCHEMBL15521859 0.67 FSCN1 (1.00) LMNAHTTKDM4EFSCN1MAPT
SCHEMBL839601 0.67 RAB9A (0.55) RAB9APIP4K2ALMNAHTTKDM4E
SCHEMBL29306049 0.66 RAB9A (0.98) RAB9APIP4K2ALMNAHTTKDM4E
SCHEMBL6265421 0.66 MAPT (1.00) PIP4K2ALMNAHTTKDM4EMAPT

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-2005047288-A1 PYRAZOLOPYRIMIDINES AS ANTI - HEPATITS C AGENTS ARROW THERAPEUTICS LIMITED (GB) 2005-05-26 WO disclosed