SCHEMBL2393577

SCHEMBL2393577

Cc1cnc(Cl)nc1OCC[Si](C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
NUDT1 P36639 2/20 0.36
PIN1 Q13526 2/20 0.34
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RPS6KA5 O75582 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
SCHEMBL19675768 0.82 NUDT1 (0.38) RXRAGRIN1GRIN2BNUDT1PIN1
SCHEMBL31533165 0.81 MEN1 (0.34) PIN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20101545 0.81 MEN1 (0.34) PIN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL20101541 0.80 ALDH1A1 (0.42) NUDT1PIN1KDM4EALDH1A1SMN1; SMN2
SCHEMBL89746 0.79 NUDT1 (0.36) RXRAGRIN1GRIN2BNUDT1PIN1
SCHEMBL20101542 0.78 PIN1 (0.51) PIN1KDM4E
SCHEMBL20107025 0.75 PIN1 (0.33) PIN1
SCHEMBL20101547 0.75 PIN1 (0.40) PIN1
SCHEMBL1996295 0.74 ALDH1A1 (0.44) RXRAGRIN1GRIN2BNUDT1PIN1
SCHEMBL20733627 0.72 RPS6KA5 (0.36) RXRAGRIN1GRIN2BNUDT1PIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079728-B1 N-ARYL PYRAZOLE COMPOUNDS FOR USE AGAINST DIABETES AMGEN INC (US) 2013-09-25 EP disclosed
US-8022061-B2 5-(Methoxymethyl)-1-(5-methyl-4-(thiophen-2-yl)pyrimidin-2-yl)-N-(pyridin-4-ylmethyl)-1H-pyrazole-4-carboxamide; for the treatment or prevention of type 2 diabetes and type 2 diabetes-related conditions AMGEN INC. (US) 2011-09-20 US disclosed
EP-2079728-A1 N-ARYL PYRAZOLE COMPOUNDS FOR USE AGAINST DIABETES Amgen Inc. (US) 2009-07-22 EP disclosed
US-20080153778-A1 N-aryl pyrazole compounds, compositions, and methods for their use AMGEN INC. 2008-06-26 US disclosed
WO-2008045484-A1 N-ARYL PYRAZOLE COMPOUNDS FOR USE AGAINST DIABETES AMGEN INC. (US) 2008-04-17 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-20080153778-A1 N-aryl pyrazole compounds, compositions, and methods for their use GLP1R, GPR119, NAT1 RXRA 506/4885GRIN1 3453/4885GRIN2B 2250/4885

“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.