SCHEMBL11605459

SCHEMBL11605459

CC(C)c1c(C(C)C)c(N)c2[nH]ncc2c1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
RET P07949 1/20 0.33
PI4KA P42356 1/20 0.33
XDH P47989 1/20 0.33
LRRK2 Q5S007 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
METAP2 P50579 2/20 0.32
CYP1A2 P05177 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
PDPK1 O15530 1/20 0.31
HTT P42858 1/20 0.31
PTK2 Q05397 1/20 0.31
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
CHEK1 O14757 1/20 0.30
AURKA O14965 1/20 0.30

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
SCHEMBL11604241 0.87 MAPT (0.39) MAPTRETPI4KAXDHLRRK2
SCHEMBL2267087 0.74 MAPT (0.46) MAPTRETPI4KAXDHLRRK2
SCHEMBL24981147 0.73 HTT (0.38) MAPTMETAP2IDO1HTTPTK2
SCHEMBL11607031 0.73 IDO1 (0.39) MAPTRETPI4KAXDHLRRK2
SCHEMBL11612665 0.73 MAPT (0.35) MAPTRETPI4KAXDHLRRK2
Hydrochloric Acid SCHEMBL11609047 0.71 MAPT (0.43) MAPTRETPI4KAXDHLRRK2
SCHEMBL11609591 0.69 MAPT (0.38) MAPTRETPI4KAXDHLRRK2
SCHEMBL1482228 0.68 RET (0.44) MAPTRETPI4KAXDHLRRK2
SCHEMBL11604269 0.67 MAPT (0.36) MAPTRETPI4KAXDHLRRK2
SCHEMBL11607563 0.66 MAPT (0.39) MAPTRETPI4KAXDHLRRK2

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
US-4104020-A OXIDIZABLE DEVELOPER-COUPLER HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1978-08-01 US disclosed