SCHEMBL2353012

SCHEMBL2353012

Cc1ccc(S(=O)(=O)OCC2CN(C(=O)OC(C)(C)C)CCC2O)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.47
MMP13 P45452 1/20 0.47
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
STS P08842 2/20 0.43
TP53 P04637 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL856352 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL505550 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL856351 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL856350 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL29895401 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL857313 0.93 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL27228981 0.91 KMT2A (0.44) GPR119MMP13KMT2AMEN1STS
SCHEMBL26907202 0.91 KMT2A (0.44) GPR119MMP13KMT2AMEN1STS
SCHEMBL12942705 0.90 GPR119 (0.48) GPR119MMP13KMT2AMEN1STS
SCHEMBL31282646 0.88 KMT2A (0.47) GPR119MMP13KMT2AMEN1STS

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-2536283-B1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA LLC (US) 2015-07-29 EP disclosed
US-9045461-B2 Phenyl-heteroaryl derivatives and methods of use thereof TRANSTECH PHARMA, LLC (US) 2015-06-02 US disclosed
US-20140206660-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof TRANSTECH PHARMA, LLC (US) 2014-07-24 US disclosed
US-8741900-B2 Phenyl-heteroaryl derivatives and methods of use thereof TRANSTECH PHARMA, LLC (US) 2014-06-03 US disclosed
US-20130197007-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof TRANSTECH PHARMA, INC. (US) 2013-08-01 US disclosed
US-8431575-B2 Phenyl-heteroaryl derivatives and methods of use thereof TRANSTECH PHARMA, INC. (US) 2013-04-30 US disclosed
EP-2536283-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TransTech Pharma, Inc (US) 2012-12-26 EP disclosed
US-20110230458-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA, INC. (US) 2011-09-22 US disclosed
WO-2011103091-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF TRANSTECH PHARMA, INC. (US) 2011-08-25 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 (3 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-20140206660-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof AGER, NOD2, GPBAR1 GPR119 16/4885MMP13 2670/4885KMT2A 4202/4885
US-20110230458-A1 PHENYL-HETEROARYL DERIVATIVES AND METHODS OF USE THEREOF AGER, PSEN2, PSEN1 GPR119 17/4885MMP13 2413/4885KMT2A 4080/4885
US-20130197007-A1 Phenyl-Heteroaryl Derivatives and Methods of Use Thereof AGER, PSEN2, PSEN1 GPR119 17/4885MMP13 2413/4885KMT2A 4080/4885

“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.