SCHEMBL5651374

SCHEMBL5651374

COc1ccc([C@H]2C[N]CCO2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ PTAFR P25105 3/20 0.44
▸ NR3C1 P04150 1/20 0.44
▸ ACHE P22303 1/20 0.43
▸ MAPK3 P27361 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.39
▸ PDE4A P27815 2/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 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
SCHEMBL5651371 1.00 ALDH1A1 (0.49) ALDH1A1PTAFRNR3C1ACHEMAPK3
SCHEMBL4973283 0.88 ALDH1A1 (0.38) ALDH1A1PTAFRACHEMAPK3MAPK1
SCHEMBL4973278 0.88 ALDH1A1 (0.38) ALDH1A1PTAFRACHEMAPK3MAPK1
SCHEMBL5654177 0.87 ALDH1A1 (0.37) ALDH1A1PTAFRACHEMAPK3MAPK1
SCHEMBL5654176 0.87 ALDH1A1 (0.37) ALDH1A1PTAFRACHEMAPK3MAPK1
SCHEMBL4157984 0.80 SLC6A2 (0.42) ALDH1A1
SCHEMBL4176881 0.80 SLC6A2 (0.42) ALDH1A1
SCHEMBL4165135 0.80 SLC6A2 (0.42) ALDH1A1
SCHEMBL4973947 0.78 LMNA (0.45) ALDH1A1KDM4E
SCHEMBL4973937 0.78 LMNA (0.45) ALDH1A1KDM4E

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-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 — — US claimed
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 — — 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-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors PDE7A, PDE10A, PDE7B ALDH1A1 416/4885PTAFR 3917/4885NR3C1 2382/4885

“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