SCHEMBL17639258

SCHEMBL17639258

C[C@H](CC#N)c1c(Br)ncnc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.44
KIT P10721 2/20 0.43
KCNH2 Q12809 1/20 0.42
MAP4K4 O95819 1/20 0.40
EGLN2 Q96KS0 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
MAPT P10636 1/20 0.38
PGGT1B P53609 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
RET P07949 1/20 0.37

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
SCHEMBL30368810 1.00 GPR119 (0.44) GPR119KITKCNH2MAP4K4EGLN2
SCHEMBL22788420 1.00 GPR119 (0.44) GPR119KITKCNH2MAP4K4EGLN2
SCHEMBL17634043 0.88 GPR119 (0.44) GPR119KITKCNH2MAP4K4EGLN2
SCHEMBL19294663 0.88 GPR119 (0.44) GPR119KITKCNH2MAP4K4EGLN2
SCHEMBL16784372 0.86 KIT (0.47) GPR119KITKCNH2MAP4K4CNR1
SCHEMBL17634059 0.85 AKT1 (0.36) KITMAPT
SCHEMBL16784431 0.84 KIT (0.46) GPR119KITKCNH2MAP4K4CNR1
SCHEMBL16784360 0.79 KIT (0.47) GPR119KITMAP4K4CNR1CNR2
SCHEMBL16624819 0.75 KIT (0.46) GPR119KITMAP4K4CNR1CNR2
SCHEMBL18950223 0.74 KIT (0.48) GPR119KITMAP4K4CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112062727-B Process for the preparation of (cyclopenta [ d ] pyrimidin-4-yl) piperazine compounds 豪夫迈·罗氏有限公司 2023-10-31 CN disclosed
US-20230122620-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS HOFFMANN-LA ROCHE INC. 2023-04-20 US disclosed
WO-2021254920-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2021-12-23 WO disclosed
US-10870626-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds F. HOFFMAN-LA ROCHE AG (CH) 2020-12-22 US disclosed
CN-112062727-A Process for preparing (cyclopenta [ d ] pyrimidin-4-yl) piperazine compounds 豪夫迈·罗氏有限公司 2020-12-11 CN disclosed
CN-107001287-B Process for preparing (cyclopenta [ d ] pyrimidin-4-yl) piperazine compounds 豪夫迈·罗氏有限公司 2020-09-04 CN disclosed
US-10457648-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds GENENTECH INC. (US) 2019-10-29 US disclosed
EP-3197875-B1 PROCESSES FOR PREPARING (CYCLOPENTYL[D]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS HOFFMANN LA ROCHE (CH) 2019-08-14 EP disclosed
US-20170247338-A1 PROCESS FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. HOFFMAN-LA ROCHE AG (CH) 2017-08-31 US disclosed
US-20170247338-A1 PROCESS FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. HOFFMAN-LA ROCHE AG (CH) 2017-08-31 US disclosed
WO-2016049414-A1 PROCESSES FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2016-03-31 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-10870626-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds PAK5, CDK5, PPIP5K2 GPR119 2698/4885KIT 428/4885KCNH2 3082/4885
US-20230122620-A1 PROCESS FOR MAKING HYDROXYLATED CYCLOPENTYLPYRIMIDINE COMPOUNDS DHPS, DPYD, TNKS GPR119 3384/4885KIT 879/4885KCNH2 3729/4885
US-20170247338-A1 PROCESS FOR PREPARING (CYCLOPENTYL[d]PYRIMIDIN-4-YL)PIPERAZINE COMPOUNDS PAK5, CDK5, PPIP5K2 GPR119 2698/4885KIT 428/4885KCNH2 3082/4885
US-10457648-B2 Process for preparing (cyclopentyl[d]pyrimidin-4-yl)piperazine compounds PAK5, CDK5, PPIP5K2 GPR119 2698/4885KIT 428/4885KCNH2 3082/4885

“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.