SCHEMBL7150696

SCHEMBL7150696

C/C=C1/CCCC2C(O[Si](C)(C)C(C)(C)C)CCCC12C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPM1D O15297 2/20 0.33

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
SCHEMBL7150700 1.00 PPM1D (0.33) PPM1D
SCHEMBL6851161 0.94 PPM1D (0.31) PPM1D
SCHEMBL4159405 0.94 PPM1D (0.31) PPM1D
SCHEMBL4159409 0.94 PPM1D (0.31) PPM1D
SCHEMBL7152133 0.82 PPM1D (0.35) PPM1D
SCHEMBL8229605 0.78
SCHEMBL20244226 0.77 CYP19A1 (0.40)
SCHEMBL21613284 0.77 CYP19A1 (0.40)
SCHEMBL13317271 0.74 PPM1D (0.32) PPM1D
SCHEMBL17180453 0.72 CYP19A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0998455-B1 DIHOMO-SECO-CHOLESTANES WITH TWO UNSATURATED BONDS IN THE SIDE CHAIN HOFFMANN LA ROCHE (CH) 2003-10-01 EP disclosed
US-6153605-A Arylsecocholadiene derivatives HOFFMAN-LA ROCHE INC. (US) 2000-11-28 US disclosed
EP-0771789-B1 1 alpha, 26-dihydroxy-D-homo-vitamin D3 HOFFMANN LA ROCHE (CH) 2000-02-16 EP disclosed
US-5994569-A USEFUL IN THE TREATMENT OR PREVENTION OF VITAMIN D DEPENDENT DISORDERS AND OF IL-12-DEPENDENT AUTOIMMUNE DISEASES HOFFMANN-LA ROCHE INC. (US) 1999-11-30 US disclosed
US-5905074-A SKIN DISORDERS, ANTITUMOR AGENTS, VITAMIN D DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 1999-05-18 US disclosed
EP-0771789-A1 1 alpha, 26-dihydroxy-D-homo-vitamin D3 F. HOFFMANN-LA ROCHE AG (CH) 1997-05-07 EP disclosed