SCHEMBL8640926

SCHEMBL8640926

CC(C)C(=O)CCn1ccnc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.62
TBXAS1 P24557 17/20 0.53
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL23844568 0.90 TBXAS1 (0.57) EGLN3TBXAS1
SCHEMBL47372 0.88 EGLN3 (0.61) EGLN3TBXAS1ALDH1A1
SCHEMBL12391736 0.83 ALDH1A1 (0.62) EGLN3TBXAS1ALDH1A1
SCHEMBL4288379 0.79 EGLN3 (0.69) EGLN3TBXAS1ALDH1A1
SCHEMBL14087955 0.79 TBXAS1 (0.48) EGLN3TBXAS1ALDH1A1
SCHEMBL21661627 0.78 EGLN3 (0.57) EGLN3TBXAS1ALDH1A1
SCHEMBL22490369 0.78 EGLN3 (0.57) EGLN3TBXAS1ALDH1A1
Hydrochloric Acid SCHEMBL3642733 0.78 EGLN3 (0.67) EGLN3TBXAS1ALDH1A1
SCHEMBL2001103 0.77 EGLN3 (1.00) EGLN3TBXAS1ALDH1A1
SCHEMBL10780853 0.76 EGLN3 (0.65) EGLN3TBXAS1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149369-A1 Compounds that Interact with the Ras Superfamily for the Treatment of Cancers, Inflammatory Diseases, Rasopathies, and Fibrotic Disease SHY Therapeutics LLC (US) 2023-05-18 US disclosed
US-11213515-B1 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease SHY Therapeutics LLC (US) 2022-01-04 US disclosed
US-5789432-A Aromatase-inhibiting composition containing azole derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-08-04 US disclosed
US-5726196-A TREATING BREAST CANCER, BENIGN BREAST DISEASE, UTERINE CANCER, PANCREATIC CRCINOMA, CUSHING'S SYNDROME NIIMURA KOICHI (JP) 1998-03-10 US disclosed
EP-0654265-A1 Aromatase-inhibiting composition containing azole derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1995-05-24 EP 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-11213515-B1 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease HRAS, KRAS, NRAS EGLN3 2796/4885TBXAS1 1065/4885ALDH1A1 3448/4885
US-20230149369-A1 Compounds that Interact with the Ras Superfamily for the Treatment of Cancers, Inflammatory Diseases, Rasopathies, and Fibrotic Disease HRAS, KRAS, NRAS EGLN3 2796/4885TBXAS1 1065/4885ALDH1A1 3448/4885

“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.