SCHEMBL357630

SCHEMBL357630

CCN(CC)C(=O)C(Br)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.48
ALDH1A1 P00352 5/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 2/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.38
NPY2R P49146 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP7 Q9UHL4 1/20 0.38

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
SCHEMBL353571 0.82 SMN1; SMN2 (0.57) HPGDALDH1A1MAPTMEN1TSHR
SCHEMBL5077951 0.82 CES2 (0.44) HPGDALDH1A1MEN1KMT2ARAB9A
SCHEMBL355557 0.81 OPRM1 (0.46) MEN1KMT2ASMN1; SMN2NPY2ROPRD1
SCHEMBL17113868 0.81 NPSR1 (0.50) HPGDALDH1A1NPSR1MAPTMEN1
SCHEMBL356507 0.76 HPGD (0.37) HPGDALDH1A1NPSR1MAPTMEN1
SCHEMBL10030170 0.76 HPGD (0.45) HPGDALDH1A1NPSR1MAPTMEN1
SCHEMBL10030148 0.76 HPGD (0.45) HPGDALDH1A1NPSR1MAPTMEN1
SCHEMBL8706715 0.75 TSHR (0.46) ALDH1A1MEN1TSHRKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL2695559 0.74 HPGD (0.44) HPGDALDH1A1NPSR1MAPTMEN1
SCHEMBL1676908 0.74 MAPT (0.46) HPGDALDH1A1NPSR1MAPTMEN1

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 HPGD 756/4885ALDH1A1 4210/4885NPSR1 17/4885

“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.