SCHEMBL5133101

SCHEMBL5133101

Cc1ccccc1C(=O)Nc1ccc(N2CC[N]CC2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRACR2A Q9BSW2 1/20 0.56
NPC1 O15118 7/20 0.51
RAB9A P51151 7/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
GAA P10253 2/20 0.51
MAPK1 P28482 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HPGD P15428 2/20 0.50
NPY2R P49146 4/20 0.49
PRNP P04156 1/20 0.49
HTT P42858 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
TP53 P04637 1/20 0.48
MTTP P55157 1/20 0.48

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
SCHEMBL5131350 0.88 KDM4E (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL5131965 0.87 RAB9A (0.60) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL5133040 0.86 CHRM5 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL5083818 0.78 NPY2R (0.80) NPY2RMTTP
SCHEMBL12638071 0.75 CRACR2A (0.79) CRACR2AKMT2A
SCHEMBL1965133 0.74 DHODH (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL29755741 0.74 DHODH (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL1876778 0.74 CRACR2A (0.78) CRACR2A
SCHEMBL23781713 0.73 HPGD (0.65) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL5133152 0.73 KDM4E (0.52) NPC1RAB9ASMN1; SMN2MAPTL3MBTL1

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-8183239-B2 Substituted piperazines and piperidines as modulators of the neuropeptide Y2 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-05-22 US disclosed
US-20070100141-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-03 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-20070100141-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS MODULATORS OF THE NEUROPEPTIDE Y2 RECEPTOR NPY2R, NPY5R, NPY4R CRACR2A 1080/4885NPC1 3192/4885RAB9A 4269/4885

“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.