SCHEMBL3853508

SCHEMBL3853508

CC(C)(C)OC(=O)N1CCN(c2ccc(CO)nc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.57
GPR119 Q8TDV5 9/20 0.57
MAPT P10636 3/20 0.54
LMNA P02545 2/20 0.54
ALDH1A1 P00352 1/20 0.54
SMN1; SMN2 Q16637 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
TSHR P16473 1/20 0.53
WNT3A P56704 1/20 0.50
CYP2C19 P33261 1/20 0.48
CKS1B P61024 1/20 0.48
SKP1 P63208 1/20 0.48
SKP2 Q13309 1/20 0.48
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NAMPT P43490 1/20 0.47

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
SCHEMBL30564998 1.00 HRH3 (0.57) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL1432797 0.88 AOC3 (0.57) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL24478925 0.86 GPR119 (0.58) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL29723281 0.86 GPR119 (0.58) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL1432556 0.85 AOC3 (0.57) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL1432960 0.84 AOC3 (0.57) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL29723056 0.84 GPR119 (0.62) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL28759744 0.84 GPR119 (0.62) HRH3GPR119MAPTLMNAALDH1A1
SCHEMBL22411451 0.83 MAPT (0.61) GPR119MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL6363304 0.83 MEN1 (0.65) GPR119MAPTLMNAALDH1A1SMN1; SMN2

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-116490506-B Fused tricyclic compounds, process for their preparation and their use in medicine 江苏恒瑞医药股份有限公司 2024-12-13 CN disclosed
EP-4253387-A1 FUSED TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2023-10-04 EP disclosed
CN-116490506-A Fused tricyclic compounds, process for their preparation and their use in medicine 江苏恒瑞医药股份有限公司 2023-07-25 CN disclosed
CN-114621230-B Nitrogen-containing heterocyclic compound, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2023-06-16 CN disclosed
CN-114621230-A Nitrogen-containing heterocyclic compound, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-06-14 CN disclosed
WO-2022111636-A1 FUSED TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE 江苏恒瑞医药股份有限公司 2022-06-02 WO disclosed
US-7572811-B2 Immunosuppressant compounds and compositions IRM LLC (BM) 2009-08-11 US disclosed
EP-1718307-A4 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2009-04-29 EP disclosed
US-20070203100-A1 Immunosuppressant Compounds and Compositions IRM LLC (BM) 2007-08-30 US disclosed
EP-1718307-A2 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM, LLC (BM) 2006-11-08 EP disclosed
WO-2005082089-A2 IMMUNOSUPPRESSANT COMPOUNDS AND COMPOSITIONS IRM LLC (BM) 2005-09-09 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 (1 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-20070203100-A1 Immunosuppressant Compounds and Compositions ICOS, EDNRA, NFATC1 HRH3 1062/4885GPR119 740/4885MAPT 3586/4885

“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.