SCHEMBL8091626

SCHEMBL8091626

C[C@H](CI)C1CCCC2C(O[Si](C)(C)C(C)(C)C)CCCC21C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 2/20 0.39
CDC25B P30305 2/20 0.39
PPM1D O15297 2/20 0.35

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
SCHEMBL8091627 1.00 CDC25A (0.39) CDC25ACDC25BPPM1D
SCHEMBL8503807 1.00 CDC25A (0.39) CDC25ACDC25BPPM1D
SCHEMBL3175300 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL14107820 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL3175294 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL3175287 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL9010602 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL14444978 0.94 CDC25A (0.45) CDC25ACDC25BPPM1D
SCHEMBL8083668 0.88 CDC25A (0.39) CDC25ACDC25BPPM1D
SCHEMBL8098457 0.88 CDC25A (0.39) CDC25ACDC25BPPM1D

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
US-6043385-A TREATMENT OF PSORIASIS, BASAL CELL CARCINOMAS, DISORDERS OF KERATINIZATION AND KERATOSIS, NEOPLASTIC DISEASES SUCH AS LEUKEMIA, DISORDERS OF THE SEBACEOUS GLANDS SUCH AS ACNE AND SEBORRHOIC DERMATITIS, OSTEOPOROSIS, HYPERPARATHYROIDISM HOFFMAN-LA ROCHE INC. (US) 2000-03-28 US disclosed
EP-0771789-B1 1 alpha, 26-dihydroxy-D-homo-vitamin D3 HOFFMANN LA ROCHE (CH) 2000-02-16 EP disclosed
EP-0771789-A1 1 alpha, 26-dihydroxy-D-homo-vitamin D3 F. HOFFMANN-LA ROCHE AG (CH) 1997-05-07 EP disclosed