SCHEMBL7837563

SCHEMBL7837563

CC(C)(C)OC(=O)N1CC=C(c2cnc3ccccc3n2)CC1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 11/20 0.59
GRM5 P41594 11/20 0.59
PDK4 Q16654 1/20 0.53
PDE10A Q9Y233 2/20 0.52
NAMPT P43490 1/20 0.50
HTR6 P50406 1/20 0.47
TNK2 Q07912 1/20 0.47
ATR Q13535 1/20 0.46

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
SCHEMBL29591544 1.00 GRM1 (0.59) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL24289433 0.86 GRM1 (0.51) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL6621771 0.85 PDE10A (0.60) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL2212585 0.83 NAMPT (0.53) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL16272023 0.82 GRM1 (0.59) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL30308912 0.82 GRM1 (0.64) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL4251822 0.81 GRM5 (0.70) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL29559340 0.81 GRM5 (0.70) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL23015101 0.81 GRM1 (0.57) GRM1GRM5PDK4PDE10ANAMPT
SCHEMBL20810424 0.80 WNT3A (0.45) GRM1GRM5PDK4PDE10ANAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 US disclosed
CN-116583509-A Compounds and methods for treating cancer 上海睿跃生物科技有限公司 2023-08-11 CN disclosed
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 WO disclosed
EP-1087962-A4 PREPARATION OF HETEROARYL COMPOUNDS LILLY CO ELI (US) 2001-10-04 EP disclosed
CN-1315830-A Method for treating anxiety disorders LILLY CO ELI (US) 2001-10-03 CN disclosed
US-6242450-B1 SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY 2001-06-05 US disclosed
EP-1087962-A1 PREPARATION OF HETEROARYL COMPOUNDS ELI LILLY AND COMPANY (US) 2001-04-04 EP disclosed
WO-2000006082-A2 TREATMENT OF ANXIETY DISORDERS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
WO-2000006166-A1 5-HT1F ANTAGONISTS ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed
EP-0976746-A1 5-HT1F antagonists ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed
EP-0976747-A2 Use of 5HT-1F receptor antagonists for treating anxiety disorders ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed
WO-1999065896-A1 PREPARATION OF HETEROARYL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-12-23 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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL GRM1 744/4885GRM5 2249/4885PDK4 1633/4885

“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.