SCHEMBL355785

SCHEMBL355785

CC(C)(C)OC(=O)N1CCN(c2ccc(C(N)=S)cc2F)CC1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 7/20 0.55
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
ALDH1A1 P00352 6/20 0.52
LMNA P02545 5/20 0.52
HPGD P15428 3/20 0.52
TSHR P16473 2/20 0.52
NPC1 O15118 1/20 0.52
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HSD17B10 Q99714 1/20 0.52
USP30 Q70CQ3 1/20 0.48
GPR119 Q8TDV5 1/20 0.46
PARP1 P09874 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL354114 0.90 L3MBTL1 (0.58) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL8251175 0.86 L3MBTL1 (0.73) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30858329 0.86 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30796039 0.86 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL354715 0.86 L3MBTL1 (0.59) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL8226813 0.86 L3MBTL1 (0.54) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL354815 0.84 L3MBTL1 (0.57) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL30858342 0.84 L3MBTL1 (0.57) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL27202624 0.83 L3MBTL1 (0.56) L3MBTL1MAPTKMT2AMEN1ALDH1A1
SCHEMBL355457 0.83 L3MBTL1 (0.54) L3MBTL1MAPTKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120015957-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2012-01-19 US disclosed
WO-2009079593-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-25 WO 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-20120015957-A1 PIPERAZINYL DERIVATIVES USEFUL AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY1R, NPY5R L3MBTL1 4722/4885MAPT 3596/4885KMT2A 3251/4885

“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.