SCHEMBL21397628

SCHEMBL21397628

CC(C)(C)OC(=O)N1CCC2(CC1)Cc1ccc(Br)cc1C2=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.43
USP30 Q70CQ3 2/20 0.41
GPR119 Q8TDV5 5/20 0.41
ALK Q9UM73 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
FPR3 P25089 2/20 0.40
FPR2 P25090 2/20 0.40
NR1H2 P55055 1/20 0.40
BACE1 P56817 1/20 0.39
RORC P51449 1/20 0.39
CRBN Q96SW2 1/20 0.38
PDK2 Q15119 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
SCHEMBL29604151 1.00 ESR2 (0.43) ESR2USP30GPR119ALKHDAC1
SCHEMBL22789685 0.91 USP30 (0.41) ESR2USP30GPR119ALKHDAC1
SCHEMBL22792391 0.90 ESR2 (0.52) ESR2USP30GPR119HDAC1HDAC8
SCHEMBL30111061 0.90 ESR2 (0.52) ESR2USP30GPR119HDAC1HDAC8
SCHEMBL1466048 0.88 ESR2 (0.42) ESR2USP30HDAC1FPR3FPR2
SCHEMBL22792848 0.87 GPR119 (0.43) ESR2USP30GPR119HDAC1HDAC8
SCHEMBL22493761 0.86 ALDH1A1 (0.48) ESR2USP30GPR119NR1H2BACE1
SCHEMBL21856129 0.86 MEN1 (0.46) ESR2USP30GPR119HDAC1HDAC8
SCHEMBL22770482 0.86 NR1H2 (0.53) ESR2USP30GPR119HDAC1HDAC8
SCHEMBL22440522 0.86 GPR119 (0.43) ESR2USP30GPR119HDAC1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4617265-A1 NITROGEN-CONTAINING SPIROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Prime Gene Therapeutics Co., Ltd. (CN) 2025-09-17 EP disclosed
US-20250223285-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO LTD (CN) 2025-07-10 US disclosed
US-12331056-B2 SHP2 phosphatase inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2025-06-17 US disclosed
EP-4506035-A2 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2025-02-12 EP disclosed
US-12209074-B2 SHP2 phosphatase allosteric inhibitor BEIJING SHENOGEN PHARMA GROUP LTD. (CN) 2025-01-28 US disclosed
US-12084447-B2 SHP2 phosphatase inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2024-09-10 US disclosed
EP-3768668-B1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS INC (US) 2024-08-28 EP disclosed
EP-3601239-B1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO LTD (CN) 2024-07-31 EP disclosed
US-20240140931-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED LIMITED (CN) 2024-05-02 US disclosed
EP-4317144-A1 HETEROCYCLE SUBSTITUTED KETONE DERIVATIVE, AND COMPOSITION AND MEDICINAL USE THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2024-02-07 EP disclosed
EP-3984999-A1 SHP2 PHOSPHATASE ALLOSTERIC INHIBITOR Beijing Shenogen Pharma Group Ltd. (CN) 2022-04-20 EP disclosed
US-10988466-B2 Heterocyclic derivatives useful as SHP2 inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2021-04-27 US disclosed
US-10934302-B1 SHP2 phosphatase inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
CN-112409334-A Novel heterocyclic derivatives useful as SHP2 inhibitors 北京加科思新药研发有限公司 2021-02-26 CN disclosed
WO-2021028362-A1 SHP2 INHIBITORS IRBM S.P.A. (IT) 2021-02-18 WO disclosed
CN-112174935-A Novel heterocyclic derivatives useful as SHP2 inhibitors 北京加科思新药研发有限公司 2021-01-05 CN disclosed
CN-112166110-A SHP2 phosphatase inhibitors and methods of use thereof 传达治疗有限公司 2021-01-01 CN disclosed
WO-2020249079-A1 SHP2 PHOSPHATASE ALLOSTERIC INHIBITOR 北京盛诺基医药科技股份有限公司 2020-12-17 WO disclosed
US-20200392128-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2020-12-17 US disclosed
WO-2019183367-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. (US) 2019-09-26 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 (8 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-20250223285-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS PTPN5, PTPN1, PTPRJ ESR2 3034/4885USP30 1145/4885GPR119 1764/4885
US-12084447-B2 SHP2 phosphatase inhibitors and methods of use thereof PTPRCAP, PTPN22, PTPN1 ESR2 1970/4885USP30 1442/4885GPR119 1069/4885
US-10988466-B2 Heterocyclic derivatives useful as SHP2 inhibitors PTPRJ, PTPN5, PTPN1 ESR2 2499/4885USP30 1139/4885GPR119 1856/4885
US-20200392128-A1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS PTPN5, PTPN1, PTPRJ ESR2 3034/4885USP30 1145/4885GPR119 1764/4885
US-10934302-B1 SHP2 phosphatase inhibitors and methods of use thereof PTPRCAP, PTPRJ, PTPRC ESR2 2029/4885USP30 1039/4885GPR119 1659/4885
US-12209074-B2 SHP2 phosphatase allosteric inhibitor PTPN1, PTPN5, PTPN18 ESR2 1895/4885USP30 1407/4885GPR119 595/4885
US-20240140931-A1 TRICYCLIC COMPOUNDS AND USES THEREOF CYP2C19, CYP3A7, CYP11B2 ESR2 2863/4885USP30 3404/4885GPR119 2870/4885
US-12331056-B2 SHP2 phosphatase inhibitors and methods of use thereof PTPRCAP, PTPN22, PTPN1 ESR2 1970/4885USP30 1442/4885GPR119 1069/4885

“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.