SCHEMBL15218248

SCHEMBL15218248

CC1(CCc2ccccc2)OCC(CO)O1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 3/20 0.39
TMEM97 Q5BJF2 2/20 0.39
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
KDM1A O60341 2/20 0.35
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
OPRM1 P35372 2/20 0.35
OPRL1 P41146 2/20 0.35
HTR1A P08908 1/20 0.34
HSD11B1 P28845 1/20 0.34

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
Acetic Acid SCHEMBL15956069 0.81 SIGMAR1 (0.44) MEN1LMNAKMT2ASIGMAR1TMEM97
SCHEMBL15218247 0.81 MEN1 (0.38) MEN1LMNAKMT2ASIGMAR1TMEM97
SCHEMBL25188962 0.79 NPC1 (0.43) LMNAKMT2ASIGMAR1TMEM97ALDH1A1
Propionic Acid SCHEMBL15955794 0.78 TMEM97 (0.41) MEN1LMNAKMT2ASIGMAR1TMEM97
SCHEMBL15955853 0.77 TMEM97 (0.41) MEN1LMNAKMT2ASIGMAR1TMEM97
Benzyl Alcohol SCHEMBL16651422 0.76 SIGMAR1 (0.52) MEN1KMT2ASIGMAR1TMEM97ALDH1A1
Butyric Acid SCHEMBL15955929 0.75 MEN1 (0.40) MEN1LMNAKMT2ASIGMAR1TMEM97
SCHEMBL10089445 0.74 TSHR (0.33) MEN1LMNAKMT2A
3-Methylbutanoic Acid SCHEMBL15956110 0.74 TMEM97 (0.39) MEN1LMNAKMT2ASIGMAR1TMEM97
SCHEMBL3262866 0.74 MEN1 (0.35) MEN1LMNAKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9896522-B2 Solid phase fluorescence labeling reagents and uses thereof THE TEXAS A&M UNIVERSITY SYSTEM (US) 2018-02-20 US disclosed
US-9896522-B2 Solid phase fluorescence labeling reagents and uses thereof THE TEXAS A&M UNIVERSITY SYSTEM (US) 2018-02-20 US disclosed
US-20130224870-A1 FLUORESCENCE LABELING REAGENTS AND USES THEREOF THE TEXAS A&M UNIVERSITY SYSTEM (US) 2013-08-29 US disclosed
US-20130224870-A1 FLUORESCENCE LABELING REAGENTS AND USES THEREOF THE TEXAS A&M UNIVERSITY SYSTEM (US) 2013-08-29 US disclosed