SCHEMBL1491297

SCHEMBL1491297

COc1cccc2cc[n+]([O-])cc12

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 20/20 0.58
BCHE P06276 14/20 0.58

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
Hydrochloric Acid SCHEMBL1759280 0.98 ACHE (0.56) ACHEBCHE
SCHEMBL754022 0.86 ACHE (0.46) ACHEBCHE
SCHEMBL1759365 0.79 GPR84 (0.53)
SCHEMBL11960608 0.79 ACHE (0.62) ACHEBCHE
SCHEMBL5894788 0.77 CYP3A4 (0.41) ACHEBCHE
SCHEMBL8185340 0.76 ACHE (0.38) ACHEBCHE
SCHEMBL3696572 0.76 CYP2A6 (0.50) ACHEBCHE
SCHEMBL16624866 0.75 KCNN2 (0.39) ACHEBCHE
SCHEMBL21266907 0.74 GPR84 (0.56) ACHEBCHE
SCHEMBL5894521 0.72 ACHE (0.44) ACHEBCHE

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017147328-A1 COMPOUNDS FOR BINDING PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9 (PCSK9) PORTOLA PHARMACEUTICALS, INC. (US) 2017-08-31 WO disclosed
US-20110294789-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY AMNESTIX, INC. 2011-12-01 US disclosed
EP-2332917-A1 Compounds for PIM kinase inhibition and for treating malignancy Sygnis Bioscience GmbH & Co. KG (DE) 2011-06-15 EP disclosed
WO-2011057784-A1 COMPOUNDS FOR PIM KINASE INHIBITION AND FOR TREATING MALIGNANCY SYGNIS BIOSCIENCE GMBH & CO. KG (DE) 2011-05-19 WO disclosed
EP-2296472-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY Amnestix, Inc. (US) 2011-03-23 EP disclosed
US-20100160297-A1 COMPOUNDS FOR PIM KINASE INHIBITION AND FOR TREATING MALIGNANCY AMNESTIX, INC. 2010-06-24 US disclosed
US-20100160297-A1 COMPOUNDS FOR PIM KINASE INHIBITION AND FOR TREATING MALIGNANCY AMNESTIX, INC. 2010-06-24 US disclosed
WO-2009151845-A9 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY AMNESTIX, INC. (US) 2010-01-28 WO disclosed
WO-2009151845-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY AMNESTIX, INC. (US) 2009-12-17 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 (2 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-20100160297-A1 COMPOUNDS FOR PIM KINASE INHIBITION AND FOR TREATING MALIGNANCY PIM1, PIM2, PIM3 ACHE 4420/4885BCHE 3898/4885
US-20110294789-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY ROCK1, IRAK1, ROCK2 ACHE 1533/4885BCHE 2228/4885

“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.