SCHEMBL3872026

SCHEMBL3872026

CC(=O)CCc1ccc(Oc2ncnc(N3CCCCC3COCC(C)C)c2[N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.57
CUL4A Q13619 1/20 0.42
MAPT P10636 4/20 0.37
HTT P42858 2/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 5/20 0.35
HPGD P15428 4/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MAPK1 P28482 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ACACB O00763 2/20 0.34
PTGS2 P35354 1/20 0.32

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
SCHEMBL388028 0.85 GPR119 (0.69) GPR119MAPTLMNAHPGDALDH1A1
SCHEMBL386159 0.78 GPR119 (0.73) GPR119MAPTHTTLMNAHPGD
SCHEMBL1674033 0.76 GPR119 (0.77) GPR119MAPTHTTLMNAHPGD
SCHEMBL1674095 0.76 GPR119 (0.73) GPR119MAPTHTTLMNAHPGD
SCHEMBL388589 0.75 GPR119 (0.72) GPR119MAPTHTTLMNAHPGD
SCHEMBL389482 0.75 GPR119 (0.72) GPR119MAPTHTTLMNAHPGD
SCHEMBL386160 0.75 GPR119 (0.74) GPR119MAPTHTTLMNAHPGD
SCHEMBL27652159 0.74 GPR119 (0.64) GPR119MAPTHTTNPC1LMNA
SCHEMBL1674020 0.74 GPR119 (0.76) GPR119MAPTHTTLMNAHPGD
SCHEMBL389430 0.73 GPR119 (1.00) GPR119MAPTALDH1A1SMN1; SMN2MAPK1

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-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. 2009-10-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090270422-A1 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto GPR119, GLP1R, GPR4 GPR119 1/4885CUL4A 1579/4885MAPT 4357/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.