SCHEMBL18376191

SCHEMBL18376191

Cn1cc2c(n1)CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.46
HDAC1 Q13547 3/20 0.43
ESR2 Q92731 1/20 0.43
MAPK1 P28482 1/20 0.42
MAPT P10636 2/20 0.40
DDB1 Q16531 2/20 0.40
CRBN Q96SW2 2/20 0.40
GPR119 Q8TDV5 2/20 0.39
NAMPT P43490 2/20 0.39
HDAC2 Q92769 2/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL16217169 0.87 ESR2 (0.52) NR1H2ESR2MAPK1MAPTGPR119
SCHEMBL16217165 0.87 MAPT (0.54) NR1H2ESR2MAPK1MAPTGPR119
SCHEMBL24417778 0.85 ESR2 (0.47) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL25862485 0.84 NR1H2 (0.44) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL22403012 0.84 PDK2 (0.50) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL17624333 0.83 HDAC1 (0.42) HDAC1MAPTNAMPTHDAC2
SCHEMBL31460333 0.82 HDAC1 (0.41) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL20738563 0.82 HDAC1 (0.41) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL24507069 0.82 HTT (0.43) NR1H2HDAC1ESR2MAPK1MAPT
SCHEMBL14358443 0.81 HDAC1 (0.40) NR1H2HDAC1ESR2MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4678634-A1 ANDROGEN RECEPTOR MODULATORS AND USES THEREOF Haihe Biopharma Co., Ltd. (CN) 2026-01-14 EP disclosed
EP-4573089-A2 KRAS INHIBITORS Bristol-Myers Squibb Company (US) 2025-06-25 EP disclosed
CN-119998275-A KRAS inhibitors 百时美施贵宝公司 2025-05-13 CN disclosed
EP-4486453-A1 BENZAMIDE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP disclosed
CN-118843616-A Benzamide compounds for the treatment of bacterial infections 豪夫迈·罗氏有限公司 2024-10-25 CN disclosed
WO-2024183793-A1 ANDROGEN RECEPTOR MODULATORS AND USES THEREOF 上海海和药物研究开发股份有限公司 2024-09-12 WO disclosed
US-20240199584-A1 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2024-06-20 US disclosed
WO-2024040109-A2 KRAS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-02-22 WO disclosed
US-11858939-B2 Hetero-halo inhibitors of histone deacetylase ALKERMES, INC. (US) 2024-01-02 US disclosed
US-11858939-B2 Hetero-halo inhibitors of histone deacetylase ALKERMES, INC. (US) 2024-01-02 US disclosed
US-20210122748-A1 BICYCLIC INHIBITORS OF HISTONE DEACETYLASE JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2021-04-29 US disclosed
US-10919902-B2 Hetero-halo inhibitors of histone deacetylase ALKERMES, INC. (US) 2021-02-16 US disclosed
US-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2020-11-05 US disclosed
US-10793567-B2 Bicyclic inhibitors of histone deacetylase RODIN THERAPEUTICS, INC. (US) 2020-10-06 US disclosed
US-20200282016-A1 Endoparasitic Depsipeptides ZOETIS SERVICES LLC 2020-09-10 US disclosed
US-20200247814-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-08-06 US disclosed
WO-2018132533-A1 BICYCLIC INHIBITORS OF HISTONE DEACETYLASE RODIN THERAPEUTICS, INC. (US) 2018-07-19 WO disclosed
US-20180194769-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-07-12 US disclosed
US-20180194769-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-07-12 US disclosed
WO-2017007756-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE RODIN THERAPEUTICS, INC (US) 2017-01-12 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 (9 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-20200282016-A1 Endoparasitic Depsipeptides VIP, PREP, NGLY1 NR1H2 2953/4885HDAC1 393/4885ESR2 701/4885
US-11858939-B2 Hetero-halo inhibitors of histone deacetylase HDAC2, HDAC1, HDAC6 NR1H2 357/4885HDAC1 2/4885ESR2 3923/4885
US-20210122748-A1 BICYCLIC INHIBITORS OF HISTONE DEACETYLASE HDAC2, HDAC1, HDAC3 NR1H2 175/4885HDAC1 2/4885ESR2 1989/4885
US-10793567-B2 Bicyclic inhibitors of histone deacetylase HDAC2, HDAC1, HDAC11 NR1H2 227/4885HDAC1 2/4885ESR2 2086/4885
US-20240199584-A1 KRAS INHIBITORS KRAS, NRAS, HRAS NR1H2 3132/4885HDAC1 2070/4885ESR2 2595/4885
US-20180194769-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE HDAC2, HDAC1, HDAC6 NR1H2 357/4885HDAC1 2/4885ESR2 3923/4885
US-20200247814-A1 HETERO-HALO INHIBITORS OF HISTONE DEACETYLASE HDAC2, HDAC1, HDAC6 NR1H2 357/4885HDAC1 2/4885ESR2 3923/4885
US-10919902-B2 Hetero-halo inhibitors of histone deacetylase HDAC2, HDAC1, HDAC6 NR1H2 357/4885HDAC1 2/4885ESR2 3923/4885
US-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF KDM1B, KDM1A, KDM2A NR1H2 216/4885HDAC1 43/4885ESR2 3116/4885

“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.