SCHEMBL3038883

SCHEMBL3038883

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.43
GAA P10253 2/20 0.43
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
TSHR P16473 3/20 0.42
POLB P06746 2/20 0.41
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 3/20 0.37
MAPT P10636 3/20 0.36
IDO1 P14902 1/20 0.35
HTR2C P28335 1/20 0.35
NPSR1 Q6W5P4 1/20 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
SCHEMBL3022449 0.94 LMNA (0.46) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL3028686 0.86 ADRB2 (0.45) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL10260646 0.83 LMNA (0.47) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL2840247 0.81 ADRB2 (0.49) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL10291709 0.81 LMNA (0.39) LMNAADRB2ADRB1ADRB3SMN1; SMN2
SCHEMBL11948444 0.77 LMNA (0.43) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL3036232 0.75 LMNA (0.52) LMNAGAATSHRPOLBHTT
SCHEMBL10267568 0.75 LMNA (0.42) LMNAGAAADRB2ADRB1ADRB3
SCHEMBL3042954 0.75 SMN1; SMN2 (0.39) LMNAGAAADRB2TSHRPOLB
SCHEMBL3040492 0.75 ATM (0.41) LMNAGAAADRB2ADRB1ADRB3

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 4 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-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 LMNA 732/4885GAA 177/4885ADRB2 3324/4885

“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.