SCHEMBL25797707

SCHEMBL25797707

CC1C(c2ccncn2)[C@H]1C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.42
CYP19A1 P11511 9/20 0.35
CYP17A1 P05093 5/20 0.35
MAPK1 P28482 1/20 0.32
KDM5A P29375 1/20 0.31
AAK1 Q2M2I8 1/20 0.30

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
SCHEMBL25777215 1.00 GPR119 (0.42) GPR119CYP19A1CYP17A1MAPK1KDM5A
SCHEMBL25912217 1.00 GPR119 (0.42) GPR119CYP19A1CYP17A1MAPK1KDM5A
SCHEMBL25797633 1.00 GPR119 (0.42) GPR119CYP19A1CYP17A1MAPK1KDM5A
SCHEMBL25777220 1.00 GPR119 (0.42) GPR119CYP19A1CYP17A1MAPK1KDM5A
SCHEMBL25777214 1.00 GPR119 (0.42) GPR119CYP19A1CYP17A1MAPK1KDM5A
SCHEMBL25797631 0.86 GPR119 (0.34) GPR119
SCHEMBL25912216 0.86 GPR119 (0.34) GPR119
SCHEMBL25912218 0.86 GPR119 (0.34) GPR119
SCHEMBL31536544 0.82 GPR119 (0.41) GPR119
SCHEMBL31536590 0.82 GPR119 (0.41) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230226186-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-20 US disclosed
CN-116457358-A Indole derivatives as RAS inhibitors for the treatment of cancer 锐新医药公司 2023-07-18 CN disclosed
US-11690915-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-07-04 US disclosed
CN-116209438-A Treatment of malignant diseases with SHP2 mutations using SOS1 inhibitors 锐新医药公司 2023-06-02 CN 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 (2 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-11690915-B2 Ras inhibitors KRAS, NRAS, HRAS GPR119 3465/4885CYP19A1 4395/4885CYP17A1 4637/4885
US-20230226186-A1 RAS INHIBITORS KRAS, NRAS, HRAS GPR119 3465/4885CYP19A1 4395/4885CYP17A1 4637/4885

“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.