SCHEMBL8038262

SCHEMBL8038262

CCCCCCCCCCCCCCCCCCC(O)(CC)N1C=NCC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDPS P14324 8/20 0.32
GGPS1 O95749 5/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL8031910 1.00 FDPS (0.32) FDPSGGPS1MEN1KMT2A
SCHEMBL8035789 1.00 FDPS (0.32) FDPSGGPS1MEN1KMT2A
SCHEMBL11807346 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL1734042 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL8031994 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL322318 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL9952987 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL5987005 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
SCHEMBL7099222 0.83 FDPS (0.36) FDPSGGPS1MEN1KMT2A
Water SCHEMBL4433027 0.82 KMT2A (0.37) MEN1KMT2A

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-6042750-A TETRAALKYLAMMONIUM HALIDE, ALKYLENEDIAMINE, ALIPHATIC HYDROCARBON HYDROXY IMIDAZOLINE, POLYOXYETHYLENE GLYCOL ESTERS AND AMINES, TRIALKANOLAMINE, AND AMINE OXYALKYLATE; PIPES Docter, Joan (US) 2000-03-28 US disclosed