SCHEMBL4237757

SCHEMBL4237757

CC1(C)CC(Oc2ccc(C#N)cc2)CC(C)(C)N1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.53
GPR119 Q8TDV5 1/20 0.39
NAAA Q02083 1/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
GAA P10253 1/20 0.38
MMP13 P45452 1/20 0.38
MMP14 P50281 1/20 0.38
FPR2 P25090 1/20 0.37
PROKR1 Q8TCW9 1/20 0.37
EZH2 Q15910 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL1471330 0.80 GAA (0.41) GAAEZH2
SCHEMBL4234096 0.79 HRH3 (0.59) HRH3GPR119NAAAFPR2PROKR1
SCHEMBL1471237 0.78 GAA (0.44) GAAEZH2KCNH2
SCHEMBL1471253 0.78 SLC6A4 (0.49) SLC6A2SLC6A4SLC6A3GAAMMP13
SCHEMBL27622911 0.78 GAA (0.41) GAAEZH2KCNH2
SCHEMBL451934 0.78 GAA (0.54) SLC6A2SLC6A4SLC6A3GAAEZH2
Hydrochloric Acid SCHEMBL1471517 0.77 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3GAAMMP13
SCHEMBL20076154 0.76 HRH3 (0.54) HRH3GPR119MMP13MMP14FPR2
SCHEMBL22138868 0.75 HRH3 (0.71) HRH3GPR119SLC6A2SLC6A4SLC6A3
SCHEMBL5024491 0.75 HRH3 (0.71) HRH3GPR119SLC6A2SLC6A4SLC6A3

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HRH3 210/4885GPR119 31/4885NAAA 2084/4885

“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.