SCHEMBL3282953

SCHEMBL3282953

CC(C)(C)[SiH2]OC(c1ccccc1)(c1ccccc1)C1CCC(C)(C=O)C1(C)C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL3283597 0.83
SCHEMBL3286411 0.78 CHRM3 (0.31) CYP2C9CYP2C19
SCHEMBL3282945 0.73
SCHEMBL187157 0.68 CYP2C9 (0.33) CYP2C9CYP2C19
SCHEMBL3283572 0.67
SCHEMBL600028 0.66 MAPK1 (0.32) CYP2C19
SCHEMBL9309557 0.65
SCHEMBL14321102 0.65 CYP3A4 (0.35)
SCHEMBL20447644 0.64 ALDH1A1 (0.36)
SCHEMBL9707224 0.64 MAPK1 (0.31) CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258126-B2 Vitamin D3 analogues for the prevention and treatment of bone disorders K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2012-09-04 US disclosed
US-20100160455-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS K.U. LEUVEN RESEARCH AND DEVELOPMENT (BE) 2010-06-24 US disclosed
US-7704986-B2 5-(((3-((4-Hydroxy,1,5-dimethylhexyl)-2,2,3-(trimethyl)cyclopentyl)-2-propenylidene)cyclohexane-1,3-diol; induce bone matrix formation; mineralization without hypercalcemia; side effect reduction; bone disorders; osteomalacia, renal osteodystrophy, Paget's disease and osteoporosis; skin disorders K.U. LEUVEN RESEARCH AND DEVELOPMENT (BE) 2010-04-27 US disclosed
EP-1809599-B1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS LEUVEN K U RES & DEV (BE) 2008-12-10 EP disclosed
US-20080032955-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS K.U. LEUVEN RESEARCH AND DEVELOPMENT (BE) 2008-02-07 US disclosed
EP-1809599-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS K.U.Leuven Research & Development (BE) 2007-07-25 EP disclosed
WO-2006039763-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2006-04-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100160455-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS VDR, CYP24A1, CYP2R1 CYP2C9 4210/4885CYP2C19 3287/4885
US-20080032955-A1 VITAMIN D3 ANALOGUES FOR THE PREVENTION AND TREATMENT OF BONE DISORDERS VDR, CYP24A1, CYP2R1 CYP2C9 4210/4885CYP2C19 3287/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.