SCHEMBL8917814

SCHEMBL8917814

Cc1cccc2c1C(=N)NC21CCCOO1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 1/20 0.33

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
SCHEMBL9093079 0.92 PDE7A (0.31) PDE7A
SCHEMBL8918925 0.86 TXNRD1 (0.38)
SCHEMBL8919413 0.83
SCHEMBL8919056 0.83 PDK2 (0.34)
SCHEMBL8920405 0.80
SCHEMBL8920860 0.80 SLC6A2 (0.32)
SCHEMBL8918900 0.80
SCHEMBL8920277 0.78 PRKCA (0.38)
SCHEMBL8921238 0.78 PRKCA (0.38)
SCHEMBL9090620 0.77 TXNRD1 (0.36)

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
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 EP disclosed