SCHEMBL8855765

SCHEMBL8855765

CN1CC=CC=C1C(N)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.31

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
SCHEMBL15262149 0.81
SCHEMBL3732473 0.81 CRHBP (0.32)
SCHEMBL1845751 0.81
SCHEMBL8855734 0.78 LMNA (0.38) PARP1
SCHEMBL8855767 0.77 PARP10 (0.30)
SCHEMBL12443797 0.76 CRHBP (0.41)
SCHEMBL9442011 0.72 ALDH1A1 (0.43)
SCHEMBL5709793 0.71 HTT (0.32)
SCHEMBL9942256 0.68
SCHEMBL19049167 0.66

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
CN-106211770-B Chromene and 1,1A, 2,7B tetrahydrochysene cyclopropane as gamma secretase modulators simultaneously [c] chromene pyrido-pyrazine diketone 辉瑞公司 2018-02-06 CN disclosed
US-5614510-A AMMONIUM SALTS PERSTORP AB (SE) 1997-03-25 US disclosed
WO-1993016705-A1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIOAVAILABILITY OF INOSITOL PHOSPHATE PERSTORP AB (SE) 1993-09-02 WO disclosed