SCHEMBL11073620

SCHEMBL11073620

CCCCCCCCCC[C@H]1CCC2C(CCC3C[C@@H](C#N)CCC32)C1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.31
LSS P48449 2/20 0.31
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP1A2 P05177 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
SCHEMBL11068129 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11073621 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11068127 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11074070 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11069248 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11074123 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11074147 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11074072 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11068131 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A
SCHEMBL11069260 1.00 EPHX1 (0.31) EPHX1LSSMEN1HTTKMT2A

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-4434073-A Perhydrophenanthrene derivatives, their preparation, and their use in liquid-crystalline dielectrics and electro-optical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-28 US disclosed