SCHEMBL4693768

SCHEMBL4693768

CC(C)(C)OC(=O)N1CCC2(CC1)COCC2O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
RECQL P46063 1/20 0.45
GPR119 Q8TDV5 2/20 0.42
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
HPGD P15428 1/20 0.40
EPHX2 P34913 1/20 0.40
EPHX1 P07099 1/20 0.39
NAMPT P43490 6/20 0.38
CCR2 P41597 1/20 0.38

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
SCHEMBL22799063 0.86 USP2 (0.50) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL19704119 0.84 USP2 (0.49) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL19704283 0.84 USP2 (0.49) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL5764149 0.82 USP2 (0.47) USP2SMN1; SMN2RECQLGPR119DDB1
SCHEMBL5766899 0.82 USP2 (0.47) USP2SMN1; SMN2RECQLGPR119DDB1
SCHEMBL5764143 0.82 USP2 (0.47) USP2SMN1; SMN2RECQLGPR119DDB1
SCHEMBL1344048 0.82 USP2 (0.50) USP2SMN1; SMN2RECQLGPR119DDB1
SCHEMBL29548956 0.79 HPGD (0.48) USP2SMN1; SMN2RECQLGPR119DDB1
SCHEMBL19736069 0.78 USP2 (0.43) USP2SMN1; SMN2RECQLGPR119HPGD
SCHEMBL29715575 0.77 USP2 (0.42) USP2SMN1; SMN2RECQLGPR119EPHX2

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12209098-B2 N-azaspirocycloalkane substituted N-heteroaryl compounds and compositions for inhibiting the activity of SHP2 NOVARTIS AG (CH) 2025-01-28 US disclosed
CN-114981268-B Pyrimidine-4 (3H) -ketone heterocyclic compound, preparation method and application thereof in medicine 北京诺诚健华医药科技有限公司 2025-01-28 CN disclosed
CN-112625028-B Compounds and compositions for inhibiting SHP2 activity 诺华股份有限公司 2024-10-29 CN disclosed
EP-3630770-B1 PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS RELAY THERAPEUTICS INC (US) 2024-08-28 EP disclosed
EP-3753941-B1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO LTD (CN) 2024-05-01 EP disclosed
US-11952386-B2 N-azaspirocycloalkane substituted N-heteroaryl compounds and compositions for inhibiting the activity of SHP2 NOVARTIS AG (CH) 2024-04-09 US disclosed
CN-115448923-B Pyrimidine-fused ring compound, preparation method and application thereof 上海青煜医药科技有限公司 2024-03-22 CN disclosed
US-11932643-B2 Substituted heterocyclic inhibitors of PTPN11 NAVIRE PHARMA, INC. (US) 2024-03-19 US disclosed
US-11840536-B2 Heterocyclic inhibitors of PTPN11 BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-12-12 US disclosed
CN-112351780-B Substituted heterocyclic inhibitors of PTPN11 纳维尔制药有限公司 2023-12-01 CN disclosed
US-20170015680-A1 N-AZASPIROCYCLOALKANE SUBSTITUTED N-HETEROARYL COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2017-01-19 US disclosed
US-20170015680-A1 N-AZASPIROCYCLOALKANE SUBSTITUTED N-HETEROARYL COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2017-01-19 US disclosed
US-20170015680-A1 N-AZASPIROCYCLOALKANE SUBSTITUTED N-HETEROARYL COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2017-01-19 US disclosed
WO-2016203404-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2016-12-22 WO disclosed
WO-2015107495-A1 N-AZASPIROCYCLOALKANE SUBSTITUTED N-HETEROARYL COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 NOVARTIS AG (CH) 2015-07-23 WO disclosed
EP-1603901-B1 TETRAHYDROPYRAN COMPOUNDS AS TACHYKININ ANTAGONISTS MERCK SHARP & DOHME (GB) 2008-10-15 EP disclosed
US-7393858-B2 Tetrahydropyran compounds as tachykinin antagonists MERCK SHARP & DOHME LTD. (GB) 2008-07-01 US disclosed
US-20060172999-A1 Tetrahydropyran compounds as tachykinin antagonists MERCK SHARP & DOHME LTD. (GB) 2006-08-03 US disclosed
EP-1603901-A1 TETRAHYDROPYRAN COMPOUNDS AS TACHYKININ ANTAGONISTS MERCK SHARP & DOHME LTD. (GB) 2005-12-14 EP disclosed
WO-2004078750-A1 TETRAHYDROPYRAN COMPOUNDS AS TACHYKININ ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2004-09-16 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 (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-20060172999-A1 Tetrahydropyran compounds as tachykinin antagonists NPSR1, NPY1R, OPRL1 USP2 4186/4885SMN1; SMN2 4072/4885RECQL 1073/4885
US-11952386-B2 N-azaspirocycloalkane substituted N-heteroaryl compounds and compositions for inhibiting the activity of SHP2 PTPN5, PTPN1, PTPN7 USP2 1924/4885SMN1; SMN2 2598/4885RECQL 786/4885
US-11932643-B2 Substituted heterocyclic inhibitors of PTPN11 PTPN11, PTPRJ, PTPRCAP USP2 1009/4885SMN1; SMN2 4080/4885RECQL 1972/4885
US-20170015680-A1 N-AZASPIROCYCLOALKANE SUBSTITUTED N-HETEROARYL COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF SHP2 PTPN5, PTPN1, PTPN7 USP2 1924/4885SMN1; SMN2 2598/4885RECQL 786/4885
US-12209098-B2 N-azaspirocycloalkane substituted N-heteroaryl compounds and compositions for inhibiting the activity of SHP2 PTPN5, PTPN1, PTPN7 USP2 1924/4885SMN1; SMN2 2598/4885RECQL 786/4885
US-11840536-B2 Heterocyclic inhibitors of PTPN11 PTPRJ, PTPN11, PTPRCAP USP2 1045/4885SMN1; SMN2 4183/4885RECQL 1932/4885

“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.