SCHEMBL5528497

SCHEMBL5528497

COc1ccc(CCNC(=S)NC[C@H]2CC[C@@H](Nc3nc(N(C)C)c4ccccc4n3)CC2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.59
▸ BCHE P06276 3/20 0.59
▸ ACHE P22303 3/20 0.59
▸ MCHR1 Q99705 13/20 0.51
▸ ADRA2A P08913 12/20 0.51
▸ NPY5R Q15761 4/20 0.51
▸ MAPT P10636 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HTR1A P08908 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ HRH1 P35367 1/20 0.45
▸ HTR2B P41595 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RAB9A P51151 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
SCHEMBL5528502 1.00 APP (0.59) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13795135 0.90 APP (0.65) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13794418 0.87 APP (0.56) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13796132 0.87 APP (0.60) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13796254 0.86 APP (0.59) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13795125 0.86 MCHR1 (0.55) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13797061 0.85 APP (0.64) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13795629 0.85 APP (0.69) APPBCHEACHEMCHR1ADRA2A
SCHEMBL13793566 0.85 MCHR1 (0.57) APPBCHEACHEMCHR1ADRA2A
SCHEMBL5522584 0.85 MCHR1 (0.58) MCHR1ADRA2ANPY5RHTR1AADRA1A

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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 — — US claimed

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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 APP 1090/4885BCHE 168/4885ACHE 226/4885

“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.

Send feedback