SCHEMBL14933766

SCHEMBL14933766

CCCCCCCCCCCCC(C)(C)OC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
CES2 O00748 4/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GGPS1 O95749 4/20 0.41
ALDH1A1 P00352 1/20 0.40
SMPD1 P17405 1/20 0.40
FDPS P14324 6/20 0.39

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
SCHEMBL16784616 1.00 GAA (0.43) GAACES2MEN1MAPTKMT2A
SCHEMBL27941469 1.00 GAA (0.43) GAACES2MEN1MAPTKMT2A
SCHEMBL27624773 1.00 GAA (0.43) GAACES2MEN1MAPTKMT2A
SCHEMBL573190 1.00 GAA (0.43) GAACES2MEN1MAPTKMT2A
Ammonia Solution, Strong SCHEMBL11314488 0.98 GAA (0.42) GAACES2MEN1MAPTKMT2A
Ammonia Solution, Strong SCHEMBL9224614 0.98 GAA (0.42) GAACES2MEN1MAPTKMT2A
SCHEMBL12060187 0.98 GAA (0.45) GAACES2MEN1MAPTKMT2A
SCHEMBL12060125 0.91 GAA (0.46) GAACES2MEN1MAPTKMT2A
SCHEMBL12696514 0.89 CES2 (0.38) GAACES2MEN1MAPTKMT2A
SCHEMBL21237867 0.86 PAM (0.42) GAACES2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150118760-A1 FLUORESCENT SENSING OF VAPORS USING TUBULAR NANOFIBRIL MATERIALS UNIVERSITY OF UTAH RESEARCH FOUNDATION 2015-04-30 US disclosed
US-20150118760-A1 FLUORESCENT SENSING OF VAPORS USING TUBULAR NANOFIBRIL MATERIALS UNIVERSITY OF UTAH RESEARCH FOUNDATION 2015-04-30 US disclosed
WO-2013066458-A2 FLUORESCENT SENSING OF VAPORS USING TUBULAR NANOFIBRIL MATERIALS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-05-10 WO disclosed