SCHEMBL7713694

SCHEMBL7713694

CC1(C)CC(CCCCNc2ncnc(Cl)n2)CC(C)(C)N1O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
FLT3 P36888 1/20 0.30
TYRO3 Q06418 1/20 0.30
MERTK Q12866 1/20 0.30
GAS6 Q14393 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
SCHEMBL27717304 0.89 FLT3 (0.36) KMT2AFLT3TYRO3MERTKGAS6
SCHEMBL2022080 0.87 KMT2A (0.45) KMT2AKDM4EGAA
SCHEMBL8651939 0.86
SCHEMBL27717300 0.83 TSHR (0.33) KMT2A
SCHEMBL8183858 0.83
SCHEMBL4813196 0.82 KMT2A (0.34) KMT2AKDM4EGAA
SCHEMBL8653406 0.81
SCHEMBL8649938 0.81 KMT2A (0.37) KMT2AFLT3TYRO3MERTKGAS6
SCHEMBL163157 0.77
SCHEMBL714018 0.75 KMT2A (0.43) KMT2AFLT3TYRO3MERTKGAS6

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-6376584-B1 OXIDATION RESISTANCE, HEAT RESISTANCE, PHOTOSTABILITY CIBA SPECIALTY CHEMICALS CORPORATION 2002-04-23 US disclosed