SCHEMBL24680259

SCHEMBL24680259

CCc1cc(O)cc2ccc(F)c(Cl)c12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 12/20 0.48
▸ ESR2 Q92731 12/20 0.48
▸ DAO P14920 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TNF P01375 1/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31

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
SCHEMBL25040924 0.83 ESR1 (0.50) ESR1ESR2BACE1MAPT
SCHEMBL26060359 0.82 ESR1 (0.49) ESR1ESR2BACE1MAPT
SCHEMBL24755557 0.82 ESR1 (0.49) ESR1ESR2BACE1MAPT
SCHEMBL25079756 0.81 ESR1 (0.48) ESR1ESR2BACE1MAPT
SCHEMBL29080161 0.81 TBXA2R (0.37) ESR1ESR2TSHRMAPT
SCHEMBL27309732 0.79 ESR1 (0.38) ESR1ESR2
SCHEMBL26502462 0.78 ESR1 (0.49) ESR1ESR2BACE1MAPT
SCHEMBL24663180 0.78 CYP3A4 (0.47) ESR1ESR2TNFRIPK1MAOA
SCHEMBL24535006 0.78 ESR1 (0.46) ESR1ESR2DAOTNFRIPK1
SCHEMBL25040639 0.77 ESR1 (0.45) ESR1ESR2BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216516-A1 GLUTARIMIDE-CONTAINING KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF TIGER BIOTHERAPEUTICS INC. 2024-07-04 — — US disclosed
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 — — US disclosed
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 — — US disclosed
WO-2023103906-A1 KRAS G12D INHIBITOR AND USE IN MEDICINE 贝达药业股份有限公司 2023-06-15 — — WO disclosed
WO-2023018812-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2023-02-16 — — WO disclosed
WO-2022188729-A1 FUSED RING DERIVATIVES USEFUL AS KRAS G12D INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-09-15 — — 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 (3 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-20240216516-A1 GLUTARIMIDE-CONTAINING KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF KRAS, VHL, HRAS ESR1 1673/4885ESR2 3118/4885DAO 2349/4885
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS ESR1 764/4885ESR2 887/4885DAO 4647/4885
US-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS ESR1 1518/4885ESR2 2178/4885DAO 4169/4885

“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.

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