SCHEMBL4041777

SCHEMBL4041777

CC(C)(C)[Si](C)(C)OC[C@@H]1CC(O)CN1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.34
RIPK1 Q13546 1/20 0.34
DPP4 P27487 2/20 0.31
DPP8 Q6V1X1 2/20 0.31
DPP9 Q86TI2 2/20 0.31
DUT P33316 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
SCHEMBL5569321 1.00 ATM (0.34) ATMRIPK1DPP4DPP8DPP9
SCHEMBL20973729 1.00 ATM (0.34) ATMRIPK1DPP4DPP8DPP9
SCHEMBL4041770 1.00 ATM (0.34) ATMRIPK1DPP4DPP8DPP9
SCHEMBL18298229 0.87 MMP2 (0.33)
SCHEMBL19550932 0.87 FKBP1A (0.30)
SCHEMBL4972513 0.86 FKBP1A (0.33) DUT
SCHEMBL4214203 0.86 FKBP1A (0.33) DUT
SCHEMBL2957842 0.86 FKBP1A (0.33) DUT
SCHEMBL4274093 0.85 CYP1A2 (0.40)
SCHEMBL5195675 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1463728-B1 FUSED CYCLIC MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION BRISTOL MYERS SQUIBB CO (US) 2009-01-14 EP disclosed
US-7432267-B2 Fused cyclic modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMAPNY (US) 2008-10-07 US disclosed
US-7001911-B2 Fused cyclic modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMPANY (US) 2006-02-21 US disclosed
US-20050282813-A1 Fused cyclic modulators of nuclear hormone receptor function SALVATI MARK E 2005-12-22 US disclosed
US-20050256048-A1 Selective androgen receptor modulators and methods for their identification, design and use SALVATI MARK E 2005-11-17 US disclosed
US-6960474-B2 Method for the treatment of a condition remediable by administration of a selective androgen receptor modulator BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-01 US disclosed
US-20040077606-A1 Fused cyclic modulators of nuclear hormone receptor function REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-04-22 US disclosed
US-20030114420-A1 Fused cyclic modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMPANY 2003-06-19 US disclosed
US-20020173445-A1 Selective androgen receptor modulators and methods for their identification, design and use BRISTOL-MYERS SQUIBB COMPANY 2002-11-21 US 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 (5 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-20050256048-A1 Selective androgen receptor modulators and methods for their identification, design and use AR, FSHR, LHCGR ATM 1750/4885RIPK1 2128/4885DPP4 3329/4885
US-20050282813-A1 Fused cyclic modulators of nuclear hormone receptor function NR2C2, NR0B2, NR0B1 ATM 2162/4885RIPK1 1974/4885DPP4 4634/4885
US-20020173445-A1 Selective androgen receptor modulators and methods for their identification, design and use AR, FSHR, LHCGR ATM 1750/4885RIPK1 2128/4885DPP4 3329/4885
US-20030114420-A1 Fused cyclic modulators of nuclear hormone receptor function NCOA1, ESRRA, NR3C1 ATM 1835/4885RIPK1 2400/4885DPP4 3752/4885
US-20040077606-A1 Fused cyclic modulators of nuclear hormone receptor function NCOA1, ESRRA, NR3C1 ATM 1835/4885RIPK1 2400/4885DPP4 3752/4885

“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.