SCHEMBL7829348

SCHEMBL7829348

CCOC1(OCC)NC(=N)c2cccc(C(C)(C)C)c21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.31
CA2 P00918 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
SCHEMBL7815267 0.83 CA2 (0.33) CA2
SCHEMBL7823082 0.80 DAO (0.31)
SCHEMBL7828017 0.79 PDK2 (0.37)
SCHEMBL7825414 0.79 NLRP3 (0.33) NLRP3
SCHEMBL7828916 0.78 NLRP3 (0.30) NLRP3CA2
SCHEMBL7816569 0.78 GAA (0.33) CA2
SCHEMBL8920434 0.76 DHFR (0.36)
SCHEMBL7824968 0.75 DDB1 (0.32)
SCHEMBL7826155 0.74 PDE5A (0.34)
SCHEMBL7826158 0.73 LTA4H (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0679640-B1 Carboxylate and heat-sensitive recording material using same MITSUI CHEMICALS INC (JP) 2001-08-08 EP disclosed
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