SCHEMBL19926323

SCHEMBL19926323

O=C(O)N1CCCc2ccc(O)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.54
CHRM4 P08173 1/20 0.54
PDK1 Q15118 9/20 0.49
PDK2 Q15119 9/20 0.49
PDK3 Q15120 9/20 0.49
PDK4 Q16654 9/20 0.49
BRD4 O60885 1/20 0.48
ATAD2 Q6PL18 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
NOTUM Q6P988 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL15880597 0.90 NOTUM (0.49) CHRM2CHRM4SMN1; SMN2NOTUMTSHR
SCHEMBL3656037 0.87 PDK1 (0.59) PDK1PDK2PDK3PDK4SMN1; SMN2
SCHEMBL21678176 0.85 NOTUM (0.64) CHRM2CHRM4PDK1PDK2PDK3
SCHEMBL13572030 0.83 ALDH1A1 (0.56) PDK1PDK2PDK3PDK4BRD4
SCHEMBL2777737 0.82 PDK1 (0.54) PDK1PDK2PDK3PDK4CA1
SCHEMBL17785806 0.82 ALDH1A1 (0.49) CHRM2PDK1PDK2PDK3PDK4
SCHEMBL27957042 0.82 MEN1 (0.51) PDK1PDK2PDK3PDK4BRD4
SCHEMBL396271 0.82 BRD4 (0.69) PDK1PDK2PDK3PDK4BRD4
SCHEMBL18616798 0.78 ALDH1A1 (0.55) BRD4ATAD2SMN1; SMN2NOTUMMEN1
SCHEMBL30804503 0.78 HSD17B10 (0.60) PDK1PDK2PDK3PDK4SMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200308155-A1 Substituted Ureas and Methods of Making and Using Same MEBIAS DISCOVERY, INC. 2020-10-01 US claimed
EP-3506983-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME Mebias Discovery LLC (US) 2019-07-10 EP claimed
US-20190194178-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME MEBIAS DISCOVERY LLC 2019-06-27 US claimed
CN-109843379-A Substituted ureas and methods of making and using the same 梅比斯发现公司 2019-06-04 CN claimed
WO-2018045229-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME MEBIAS DISCOVERY LLC (US) 2018-03-08 WO claimed
CN-109843379-B Substituted ureas and methods of making and using the same 梅比斯发现公司 2022-12-30 CN disclosed
US-11198685-B2 Substituted ureas and methods of making and using same MEBIAS DISCOVERY, INC. (US) 2021-12-14 US disclosed
US-20200308155-A1 Substituted Ureas and Methods of Making and Using Same MEBIAS DISCOVERY, INC. 2020-10-01 US disclosed
US-10683283-B2 Substituted ureas and methods of making and using same MEBIAS DISCOVERY, INC. (US) 2020-06-16 US disclosed
EP-3506983-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME Mebias Discovery LLC (US) 2019-07-10 EP disclosed
US-20190194178-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME MEBIAS DISCOVERY LLC 2019-06-27 US disclosed
WO-2018045229-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME MEBIAS DISCOVERY LLC (US) 2018-03-08 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 (4 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-10683283-B2 Substituted ureas and methods of making and using same UMPS, METTL3, UTS2R CHRM2 2042/4885CHRM4 2323/4885PDK1 4823/4885
US-20190194178-A1 SUBSTITUTED UREAS AND METHODS OF MAKING AND USING SAME UMPS, METTL3, UTS2R CHRM2 2042/4885CHRM4 2323/4885PDK1 4823/4885
US-11198685-B2 Substituted ureas and methods of making and using same UMPS, METTL3, UTS2R CHRM2 2042/4885CHRM4 2323/4885PDK1 4823/4885
US-20200308155-A1 Substituted Ureas and Methods of Making and Using Same UMPS, METTL3, UTS2R CHRM2 2042/4885CHRM4 2323/4885PDK1 4823/4885

“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.