SCHEMBL20163127

SCHEMBL20163127

CC(C)(C)OC(=O)NN(C(=O)c1nc(N2CCN(C(=O)OC(C)(C)C)CC2)cs1)c1cccc(-c2ccncc2)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.41
SKP1 P63208 2/20 0.41
SKP2 Q13309 2/20 0.41
GPR119 Q8TDV5 5/20 0.40
TBK1 Q9UHD2 1/20 0.40
WNT3A P56704 1/20 0.38
GBA1 P04062 2/20 0.38
KIT P10721 2/20 0.38
HDAC2 Q92769 1/20 0.37
ALK Q9UM73 1/20 0.37
ACKR3 P25106 2/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
LRRK2 Q5S007 1/20 0.36
BACE1 P56817 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
SCHEMBL20163033 0.90 GPR119 (0.41) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL28314027 0.90 HDAC2 (0.49) HDAC2
SCHEMBL20163018 0.88 ABCB1 (0.45) CKS1BSKP1SKP2GPR119GBA1
SCHEMBL20163158 0.86 GPR119 (0.42) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL20163021 0.84 CKS1B (0.45) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL20163014 0.84 TBK1 (0.50) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL20163146 0.84 GPR119 (0.42) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL20163129 0.83 GPR119 (0.41) CKS1BSKP1SKP2GPR119TBK1
SCHEMBL20163040 0.79 CTSS (0.42) CKS1BSKP1SKP2GPR119WNT3A
SCHEMBL20163026 0.78 GBA1 (0.45) CKS1BSKP1SKP2GPR119GBA1

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 CKS1B 366/4885SKP1 1856/4885SKP2 110/4885
US-11542242-B2 Substituted piperazines as selective HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 CKS1B 363/4885SKP1 1658/4885SKP2 126/4885
US-20180141923-A1 SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 CKS1B 246/4885SKP1 1802/4885SKP2 211/4885
US-10774056-B2 Substituted piperazines as selective HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 CKS1B 573/4885SKP1 1022/4885SKP2 57/4885
US-20200377465-A1 SUBSTITUTED PIPERAZINES AS SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 CKS1B 436/4885SKP1 1189/4885SKP2 72/4885
US-20190330169-A1 SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 CKS1B 246/4885SKP1 1802/4885SKP2 211/4885

“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.