SCHEMBL21086263

SCHEMBL21086263

CCCC(C)(C)OC(=O)C(C)(C)n1cc(C)cn1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
ELANE P08246 1/20 0.30

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
SCHEMBL16985332 0.80 CYP4F2 (0.45) CYP4F2CYP4A11
SCHEMBL12837968 0.71 LMNA (0.44) CYP4F2CYP4A11ELANE
SCHEMBL25026366 0.71 ALDH1A1 (0.34)
SCHEMBL24861843 0.70 JAK2 (0.33)
SCHEMBL29427398 0.69 CYP4F2 (0.31) CYP4F2CYP4A11
SCHEMBL29427376 0.69 CYP4F2 (0.31) CYP4F2CYP4A11
SCHEMBL20910330 0.67 LMNA (0.36)
SCHEMBL21086581 0.67 NOS1 (0.39)
SCHEMBL17545748 0.66 LMNA (0.38) CYP4F2CYP4A11ELANE
SCHEMBL24354406 0.66 KDM4E (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492452-A1 PRODUCTION METHOD FOR PYRAZOLE-AMIDE COMPOUND Japan Tobacco, Inc. (JP) 2019-06-05 EP disclosed