SCHEMBL26643382

SCHEMBL26643382

CC(C)(C)OC(=O)N1[C@@H](C(=O)O)CCC12CC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.39
▸ CHRM2 P08172 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ EPHX1 P07099 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ GPR119 Q8TDV5 1/20 0.34
▸ DDB1 Q16531 2/20 0.33
▸ CRBN Q96SW2 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ SPHK1 Q9NYA1 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NR1H2 P55055 1/20 0.33

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
SCHEMBL17033096 1.00 HSD17B10 (0.39) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL17979376 1.00 HSD17B10 (0.39) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL17031894 0.87 CHRM2 (0.38) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL26112972 0.84 EPHX1 (0.38) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL26112977 0.84 EPHX1 (0.38) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL19616822 0.84 HSD17B10 (0.39) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL1579022 0.84 HSD17B10 (0.39) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL5142783 0.84 HSD17B10 (0.39) HSD17B10CHRM2CHRM1CHRM3HPGD
SCHEMBL24189702 0.80 CHRM2 (0.44) CHRM2CHRM1CHRM3HPGDEPHX1
SCHEMBL25276005 0.77 CHRM2 (0.38) CHRM2CHRM1CHRM3HPGDEPHX1

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-20260007678-A1 COMBINATION OF ALLOSTERIC AND ORTHOSTERIC EGFR INHIBITORS FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2026-01-08 — — US disclosed
US-20250313565-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2025-10-09 — — US disclosed
EP-4522113-A1 COMBINATION OF ALLOSTERIC AND ORTHOSTERIC EGFR INHIBITORS FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2025-03-19 — — EP disclosed
CN-119173253-A Combination of allosteric and orthosteric EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-12-20 — — CN disclosed
CN-119173518-A Indazole derivatives 豪夫迈·罗氏有限公司 2024-12-20 — — CN disclosed
WO-2023217924-A1 COMBINATION OF ALLOSTERIC AND ORTHOSTERIC EGFR INHIBITORS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2023-11-16 — — 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-20260007678-A1 COMBINATION OF ALLOSTERIC AND ORTHOSTERIC EGFR INHIBITORS FOR THE TREATMENT OF CANCER EGFR, ERBB2, ERBB3 HSD17B10 1583/4885CHRM2 1807/4885CHRM1 1560/4885
US-20250313565-A1 NEW INDAZOLE DERIVATIVES CYP3A43, ABCB11, CYP3A7 HSD17B10 1162/4885CHRM2 521/4885CHRM1 535/4885

“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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