SCHEMBL8896713

SCHEMBL8896713

COC1=CC(=NC#N)C(Cl)=CC1=NC#N

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.32

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
SCHEMBL14129374 0.88 PABPC1 (0.34) PABPC1
SCHEMBL8896212 0.88 PABPC1 (0.34) PABPC1
SCHEMBL11910568 0.83
SCHEMBL8894447 0.78
SCHEMBL8896220 0.77 ALOX5 (0.37)
SCHEMBL11910126 0.69
SCHEMBL11910567 0.60
SCHEMBL2861669 0.60
SCHEMBL18634862 0.60
SCHEMBL14014018 0.60 LTA4H (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0582290-B1 Electron density storage device UNIV JOHNS HOPKINS (US) 1997-10-29 EP claimed
EP-0582290-A2 Electron density storage device MITSUBISHI CHEMICAL CORPORATION (JP) 1994-02-09 EP claimed
US-5216661-A ELECTRON DENSITY STORAGE DEVICE USING A STM THE JOHNS HOPKINS UNIVERSITY (US) 1993-06-01 US claimed
EP-0582290-B1 Electron density storage device UNIV JOHNS HOPKINS (US) 1997-10-29 EP disclosed
EP-0582290-A2 Electron density storage device MITSUBISHI CHEMICAL CORPORATION (JP) 1994-02-09 EP disclosed
US-5216661-A ELECTRON DENSITY STORAGE DEVICE USING A STM THE JOHNS HOPKINS UNIVERSITY (US) 1993-06-01 US disclosed