SCHEMBL18878486

SCHEMBL18878486

CC1C2CC(C(=O)OCC(=O)OC3(C)CCCCC3)C(C2)C1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.35
SCN1A P35498 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN3A Q9NY46 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
SCHEMBL18675601 0.99 CYP19A1 (0.33) CYP19A1SCN1ASCN2ASCN3A
SCHEMBL18675604 0.86 CYP19A1 (0.33) CYP19A1
SCHEMBL18675595 0.85
SCHEMBL2680946 0.85 SCN1A (0.40) CYP19A1SCN1ASCN2ASCN3A
SCHEMBL2681886 0.84 SCN1A (0.41) CYP19A1SCN1ASCN2ASCN3A
SCHEMBL30209814 0.80 CYP19A1 (0.34) CYP19A1
SCHEMBL30210001 0.79 CYP19A1 (0.33) CYP19A1
SCHEMBL16866407 0.78 ALDH1A1 (0.34)
SCHEMBL18675589 0.78 SCN1A (0.43) SCN1ASCN2ASCN3A
SCHEMBL12429883 0.75 ALDH1A1 (0.32)

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
US-20170146907-A1 RESIN COMPOSITION FOR UNDERLAYER FILM FORMATION, LAYERED PRODUCT, METHOD FOR FORMING PATTERN, IMPRINT FORMING KIT AND PROCESS FOR PRODUCING DEVICE FUJIFILM CORPORATION (JP) 2017-05-25 US disclosed