SCHEMBL9359559

SCHEMBL9359559

CCCCC[C@]1(OCC)CC[C@@H](C2CCCCC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
NAAA Q02083 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
SCHEMBL10347228 1.00 CYP1A2 (0.33) CYP1A2NAAA
SCHEMBL9359554 1.00 CYP1A2 (0.33) CYP1A2NAAA
SCHEMBL8412408 0.88
SCHEMBL9759411 0.88
SCHEMBL10347215 0.85 CYP1A2 (0.34) CYP1A2NAAA
SCHEMBL10346870 0.85 CYP1A2 (0.34) CYP1A2NAAA
SCHEMBL4804344 0.85 CYP1A2 (0.34) CYP1A2NAAA
SCHEMBL4719090 0.84 CYP1A2 (0.30) CYP1A2
SCHEMBL4719089 0.84 CYP1A2 (0.30) CYP1A2
SCHEMBL9646175 0.83 MEN1 (0.35) CYP1A2

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
EP-0394417-B1 SUPERTWIST LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 1994-10-26 EP disclosed
EP-0394417-A1 SUPERTWIST LIQUID CRYSTAL DISPLAY. MERCK PATENT GMBH (DE) 1990-10-31 EP disclosed
EP-0366985-A1 Super twist liquid crystal display MERCK PATENT GmbH (DE) 1990-05-09 EP disclosed