SCHEMBL20163146

SCHEMBL20163146

CC(C)(C)OC(=O)NN(C(=O)c1ccc2nc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc2c1)c1cccc(-c2ccncc2)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.42
TBK1 Q9UHD2 1/20 0.42
MAP4K4 O95819 1/20 0.41
CKS1B P61024 2/20 0.40
SKP1 P63208 2/20 0.40
SKP2 Q13309 2/20 0.40
GBA1 P04062 2/20 0.39
PDE10A Q9Y233 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP17A1 P05093 1/20 0.39
WNT3A P56704 1/20 0.39
KIT P10721 1/20 0.36
BACE1 P56817 1/20 0.36
LRRK2 Q5S007 1/20 0.36
SLC2A1 P11166 1/20 0.36
NAMPT P43490 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
SCHEMBL20163014 0.88 TBK1 (0.50) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL15970598 0.88 MAP4K4 (0.43) GPR119MAP4K4CKS1BSKP1SKP2
SCHEMBL20163127 0.84 CKS1B (0.41) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20163021 0.82 CKS1B (0.45) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20163092 0.81 GPR119 (0.48) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20163129 0.80 GPR119 (0.41) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20163158 0.79 GPR119 (0.42) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20181823 0.79 TBK1 (0.48) GPR119TBK1MAP4K4PDE10AKDM4E
SCHEMBL20163059 0.78 CKS1B (0.44) GPR119TBK1CKS1BSKP1SKP2
SCHEMBL20163029 0.77 GPR119 (0.44) GPR119TBK1CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542242-B2 Substituted piperazines as selective HDAC1,2 inhibitors REGENACY PHARMACEUTICALS, LLC (US) 2023-01-03 US disclosed
US-20200377465-A1 SUBSTITUTED PIPERAZINES AS SELECTIVE HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC 2020-12-03 US disclosed
US-10774056-B2 Substituted piperazines as selective HDAC1,2 inhibitors REGENACY PHARMACEUTICALS, INC. (US) 2020-09-15 US disclosed
US-20190330169-A1 SELECTIVE HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC 2019-10-31 US disclosed
EP-3544969-A1 PIPERAZINE DERIVATIVES AS SELECTIVE HDAC1,2 INHIBITORS Regenacy Pharmaceuticals, LLC (US) 2019-10-02 EP disclosed
US-10385031-B2 Substituted piperazines as selective HDAC1,2 inhibitors REGENACY PHARMACEUTICALS, LLC (US) 2019-08-20 US disclosed
WO-2018098296-A1 PIPERAZINE DERIVATIVES AS SELECTIVE HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC (US) 2018-05-31 WO disclosed
US-20180141923-A1 SELECTIVE HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC 2018-05-24 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 (6 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-10385031-B2 Substituted piperazines as selective HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 GPR119 1458/4885TBK1 2876/4885MAP4K4 1657/4885
US-11542242-B2 Substituted piperazines as selective HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 GPR119 1354/4885TBK1 3275/4885MAP4K4 972/4885
US-20180141923-A1 SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 GPR119 1560/4885TBK1 2693/4885MAP4K4 1239/4885
US-10774056-B2 Substituted piperazines as selective HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 GPR119 2449/4885TBK1 2844/4885MAP4K4 1236/4885
US-20200377465-A1 SUBSTITUTED PIPERAZINES AS SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 GPR119 1880/4885TBK1 2948/4885MAP4K4 1202/4885
US-20190330169-A1 SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 GPR119 1560/4885TBK1 2693/4885MAP4K4 1239/4885

“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.