SCHEMBL25354116

SCHEMBL25354116

CC(C)(C)OC(=O)CC(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
L3MBTL1 Q9Y468 3/20 0.49
GAA P10253 1/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 2/20 0.46
VNN1 O95497 1/20 0.45
TSHR P16473 1/20 0.44
KMT2A Q03164 2/20 0.43
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
NFKB1 P19838 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 3/20 0.41
PMP22 Q01453 1/20 0.41
NLRP3 Q96P20 1/20 0.41

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
SCHEMBL30576925 0.94 MAPT (0.47) MAPTL3MBTL1GAAPOLBALDH1A1
SCHEMBL2427540 0.86 MAPT (0.56) MAPTL3MBTL1GAAPOLBALDH1A1
SCHEMBL27053828 0.85 HPGD (0.49) MAPTL3MBTL1GAAALDH1A1VNN1
SCHEMBL23043726 0.84 KDM4E (0.49) GAAPOLBVNN1KMT2ARAB9A
SCHEMBL31048202 0.84 L3MBTL1 (0.44) L3MBTL1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL5089657 0.83 CA12 (0.47) L3MBTL1ALDH1A1VNN1TSHRKMT2A
SCHEMBL6025472 0.83 ALDH1A1 (0.56) MAPTL3MBTL1POLBALDH1A1TSHR
SCHEMBL13092558 0.82 GAA (0.50) MAPTL3MBTL1GAAPOLBALDH1A1
SCHEMBL20583636 0.81 LMNA (0.50) MAPTL3MBTL1GAAALDH1A1TSHR
SCHEMBL31552196 0.80 RIPK1 (0.42)

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-20250154170-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2025-05-15 US disclosed
EP-4476221-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS Bayer Aktiengesellschaft (DE) 2024-12-18 EP disclosed
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 US disclosed
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 US disclosed
WO-2023152255-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-17 WO disclosed
WO-2023152255-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-08-17 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 (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-20250154170-A1 FUSED PYRIMIDINES AS KRAS INHIBITORS KRAS, NRAS, TP53 MAPT 4220/4885L3MBTL1 2216/4885GAA 2436/4885
US-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS MAPT 3825/4885L3MBTL1 3503/4885GAA 2908/4885

“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.