SCHEMBL7715217

SCHEMBL7715217

CCCCCCCCNc1ncnc(NCCCCC2CC(C)(C)N(OCC(C)(C)O)C(C)(C)C2)n1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 12/20 0.34
FLT3 P36888 10/20 0.34
TYRO3 Q06418 10/20 0.34
GAS6 Q14393 10/20 0.34
KMT2A Q03164 1/20 0.33
DNM2 P50570 2/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
AXL P30530 1/20 0.31
KCNH3 Q9ULD8 1/20 0.31

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
SCHEMBL6298187 0.93 KMT2A (0.38) MERTKFLT3TYRO3GAS6KMT2A
SCHEMBL7715499 0.91 KMT2A (0.31) KMT2A
SCHEMBL6298350 0.89 KMT2A (0.31) KMT2A
SCHEMBL8183858 0.88
SCHEMBL6298436 0.88
SCHEMBL164474 0.87 MERTK (0.34) MERTKFLT3TYRO3GAS6KMT2A
SCHEMBL7715215 0.84 FLT3 (0.32) MERTKFLT3TYRO3GAS6KMT2A
SCHEMBL6299669 0.83 KMT2A (0.36) KMT2A
SCHEMBL6305531 0.83 KMT2A (0.38) KMT2A
SCHEMBL6300705 0.81 KMT2A (0.36) KMT2A

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