SCHEMBL14970581

SCHEMBL14970581

CC(C)c1ccc(OCCCCN2CCCCCC2)cc1

nearest known ligand 0.88

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.88
KMT2A Q03164 4/20 0.88
HRH3 Q9Y5N1 12/20 0.68
PSMB1 P20618 1/20 0.68
PSMB5 P28074 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.66
ATM Q13315 1/20 0.66
NPC1 O15118 1/20 0.63
RAB9A P51151 1/20 0.63
LMNA P02545 2/20 0.63
ALDH1A1 P00352 1/20 0.63
HTT P42858 1/20 0.61

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
SCHEMBL492315 0.95 MEN1 (0.97) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL5857827 0.94 MEN1 (0.94) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL19287693 0.94 MEN1 (1.00) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL10223295 0.91 PSMB1 (0.82) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL11977007 0.89 MEN1 (0.85) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL9527128 0.88 MEN1 (0.77) MEN1KMT2AHRH3PSMB1PSMB5
Hydrochloric Acid SCHEMBL9528262 0.86 KMT2A (0.75) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL23474922 0.86 MEN1 (0.79) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL491582 0.85 MEN1 (0.69) MEN1KMT2AHRH3PSMB1PSMB5
SCHEMBL14287709 0.84 MEN1 (0.76) MEN1KMT2AHRH3PSMB1PSMB5

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-2013074965-A1 AMINOALKYL PHENOL ETHER INHIBITORS OF INFLUENZA A VIRUS MICROBIOTIX, INC. (US) 2013-05-23 WO disclosed