SCHEMBL8562891

SCHEMBL8562891

Cc1cc2c(cc1Cl)nnn2C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 4/20 0.47
▸ RAB9A P51151 5/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ SLC9A1 P19634 1/20 0.42
▸ HCAR3 P49019 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ MGAM O43451 3/20 0.40
▸ AMY1A P0DUB6 3/20 0.40
▸ GAA P10253 3/20 0.40
▸ SI P14410 3/20 0.40
▸ MGAM2 Q2M2H8 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CYP19A1 P11511 3/20 0.36
▸ CYP11B1 P15538 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL25556243 0.92 KEAP1 (0.47) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL7854822 0.86 KEAP1 (0.39) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL19848287 0.86 KEAP1 (0.47) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL8221347 0.84 RAB9A (0.51) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL3283322 0.79 MGAM (0.42) KEAP1RAB9ANPC1MGAMAMY1A
SCHEMBL10777056 0.79 KEAP1 (0.41) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL31475782 0.77 RAB9A (0.47) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL12121754 0.77 RAB9A (0.43) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL25559702 0.77 ATAD2 (0.44) KEAP1RAB9ANPC1SLC9A1HCAR3
SCHEMBL6268160 0.77 MGAM (0.43) KEAP1MGAMAMY1AGAASI

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-20240174583-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES DOW TECHNOLOGY INVESTMENTS LLC (US) 2024-05-30 — — US disclosed
EP-4347544-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES Dow Technology Investments LLC (US) 2024-04-10 — — EP disclosed
CN-117242047-A Process for the vapor phase hydrogenation of aldehydes 陶氏技术投资有限责任公司 2023-12-15 — — CN disclosed
WO-2022250790-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES DOW TECHNOLOGY INVESTMENTS LLC (US) 2022-12-01 — — WO disclosed
EP-0873292-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-10-28 — — EP disclosed
WO-1997020798-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-06-12 — — 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-20240174583-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES ADH1C, ADH5, ALDH2 KEAP1 500/4885RAB9A 2415/4885NPC1 4654/4885

“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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