SCHEMBL3301345

SCHEMBL3301345

CC(C)(C)OC(=O)N1CCN(c2ccnc(-n3ccc4cc(NS(=O)(=O)c5cc(Cl)cc(Cl)c5)ccc43)n2)CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STS P08842 3/20 0.43
TGFBR1 P36897 3/20 0.40
GPR119 Q8TDV5 2/20 0.40
HTR6 P50406 2/20 0.39
CHRNA7 P36544 1/20 0.39
ACHE P22303 2/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
SUV39H2 Q9H5I1 2/20 0.37
MAP4K4 O95819 1/20 0.37
WNT3A P56704 1/20 0.37
POLB P06746 1/20 0.37
PAX8 Q06710 1/20 0.37
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36

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
SCHEMBL3302786 0.88 STS (0.45) STSTGFBR1GPR119HTR6WNT3A
SCHEMBL3299763 0.88 STS (0.46) STSTGFBR1GPR119HTR6SUV39H2
SCHEMBL3301597 0.86 STS (0.45) STSTGFBR1GPR119HTR6
SCHEMBL3303219 0.85 CKS1B (0.37) STSGPR119CHRNA7ACHESUV39H2
SCHEMBL3298178 0.83 GPR119 (0.44) STSTGFBR1GPR119HTR6CHRNA7
SCHEMBL3302638 0.82 STS (0.43) STSTGFBR1GPR119HTR6PSEN1
SCHEMBL3300462 0.82 CHRNA7 (0.37) STSGPR119CHRNA7ACHESUV39H2
SCHEMBL3302889 0.82 STS (0.41) STSTGFBR1GPR119HTR6
SCHEMBL3303222 0.79 USP2 (0.36) STSGPR119CHRNA7ACHESUV39H2
SCHEMBL3300783 0.78 F2 (0.38) STSHTR6PSEN1PSEN2APH1B

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
EP-2121600-B1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2012-07-18 EP disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
EP-2121600-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2009-11-25 EP disclosed
WO-2008099000-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-21 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 (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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 STS 392/4885TGFBR1 1888/4885GPR119 177/4885

“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.