SCHEMBL24535305

SCHEMBL24535305

CC(C)(C)OC(=O)N1CCCn2nc(C(=O)N3CCCC3)cc2C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ABL1 P00519 1/20 0.42
▸ RIN1 Q13671 1/20 0.42
▸ NR1H2 P55055 2/20 0.42
▸ POLB P06746 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ SCD5 Q86SK9 1/20 0.40
▸ CFTR P13569 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PDK1 Q15118 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ GPR119 Q8TDV5 3/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39

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
SCHEMBL30793266 0.93 MEN1 (0.46) MEN1KMT2ANR1H2POLBESR2
SCHEMBL30706765 0.92 USP2 (0.49) MEN1KMT2AABL1RIN1NR1H2
SCHEMBL24535310 0.92 USP2 (0.49) MEN1KMT2ANR1H2POLBESR2
SCHEMBL16102411 0.90 NR1H2 (0.42) MEN1KMT2ANR1H2POLBESR2
SCHEMBL25337734 0.90 NR1H2 (0.42) MEN1KMT2AABL1RIN1NR1H2
SCHEMBL24536649 0.89 NR1H2 (0.42) MEN1KMT2ANR1H2POLBESR2
SCHEMBL30793424 0.88 NR1H2 (0.51) MEN1KMT2AABL1RIN1NR1H2
SCHEMBL25336926 0.88 NR1H2 (0.51) MEN1KMT2AABL1RIN1NR1H2
SCHEMBL25336699 0.87 NR1H2 (0.40) MEN1KMT2AABL1RIN1NR1H2
SCHEMBL24535888 0.87 NR1H2 (0.42) MEN1KMT2AABL1RIN1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4262803-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. (US) 2023-10-25 — — EP disclosed
US-20220194961-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. 2022-06-23 — — US disclosed
WO-2022133038-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. (US) 2022-06-23 — — 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-20220194961-A1 TETRAHYDROPYRIDOPYRIMIDINE PAN-KRAS INHIBITORS KRAS, NRAS, HRAS MEN1 948/4885KMT2A 1207/4885ABL1 83/4885

“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.

Send feedback