SCHEMBL3028892

SCHEMBL3028892

CNC(=O)N1CCc2cc(N(CP(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C)S(=O)(=O)c3cc(Cl)cc(Cl)c3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
LMNA P02545 5/20 0.35
GAA P10253 2/20 0.35
TSHR P16473 3/20 0.35
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.35
PTPN11 Q06124 4/20 0.35
RORC P51449 1/20 0.34
THRB P10828 2/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
TP53 P04637 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 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
SCHEMBL3023286 0.92 LMNA (0.44) LMNAGAATSHRHTTSMN1; SMN2
SCHEMBL10260786 0.89 PTPN11 (0.38) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL10267568 0.88 LMNA (0.42) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL13941248 0.85 LMNA (0.43) LMNAGAATSHRHTTSMN1; SMN2
SCHEMBL3028686 0.84 ADRB2 (0.45) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL13940669 0.82 PTPN11 (0.37) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL3028897 0.81 ADRB2 (0.35) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL3028894 0.81 ADRB2 (0.35) ADRB2ADRB1ADRB3LMNAGAA
SCHEMBL10260833 0.80 LMNA (0.43) LMNAGAATSHRHTTSMN1; SMN2
SCHEMBL3034554 0.80 LMNA (0.42) LMNAGAATSHRHTTSMN1; SMN2

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
US-8211923-B2 Substituted arylsulfonylaminomethylphosphonic acid derivatives, their preparation and their use in the treatment of type I and II diabetes mellitus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-07-03 US disclosed
US-8211923-B2 Substituted arylsulfonylaminomethylphosphonic acid derivatives, their preparation and their use in the treatment of type I and II diabetes mellitus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-07-03 US disclosed
US-8211923-B2 Substituted arylsulfonylaminomethylphosphonic acid derivatives, their preparation and their use in the treatment of type I and II diabetes mellitus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-07-03 US disclosed
US-20100210595-A1 SUBSTITUTED ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF TYPE I AND II DIABETES MELLITUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-19 US disclosed
US-20100210595-A1 SUBSTITUTED ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF TYPE I AND II DIABETES MELLITUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-19 US disclosed
US-20100210595-A1 SUBSTITUTED ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF TYPE I AND II DIABETES MELLITUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-19 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 (1 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-20100210595-A1 SUBSTITUTED ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE TREATMENT OF TYPE I AND II DIABETES MELLITUS G6PC1, PYGL, PPP1CA ADRB2 3324/4885ADRB1 1318/4885ADRB3 2975/4885

“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.