SCHEMBL9033449

SCHEMBL9033449

COC(=O)C1(NC=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.38
MAPT P10636 1/20 0.36
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL3815734 0.91 MAPT (0.45) NPSR1MAPTALDH1A1L3MBTL1LMNA
SCHEMBL9613268 0.91 MAPT (0.41) NPSR1MAPTALDH1A1L3MBTL1LMNA
SCHEMBL7205756 0.90 MAPT (0.47) NPSR1MAPTALDH1A1L3MBTL1LMNA
SCHEMBL12049719 0.86 CYP3A4 (0.38) NPSR1MAPTALDH1A1L3MBTL1
SCHEMBL12380772 0.86 KMT2A (0.33) NPSR1MAPTALDH1A1
SCHEMBL5640425 0.80 KDM4E (0.39) NPSR1MAPTALDH1A1L3MBTL1
SCHEMBL208348 0.79 MGAM (0.37) NPSR1ALDH1A1LMNA
SCHEMBL3239495 0.73
SCHEMBL1189812 0.73
SCHEMBL9781658 0.72 CYP4F2 (0.36) NPSR1MAPTALDH1A1L3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117045653-A Diseases and treatments associated with toxic aldehydes 奥尔德拉医疗公司 2023-11-14 CN disclosed
CN-111135171-B Diseases and treatments associated with toxic aldehydes 奥尔德拉医疗公司 2023-09-08 CN disclosed
CN-114085236-A Aldehyde conjugates and uses thereof 奥尔德拉医疗公司 2022-02-25 CN disclosed
CN-111135171-A Diseases and treatments associated with toxic aldehydes 奥尔德拉医疗公司 2020-05-12 CN disclosed
CN-105120866-B Diseases and treatments associated with toxic aldehydes 奥尔德拉医疗公司 2020-02-14 CN disclosed
EP-0705834-A1 Quinoxaline-2,3-diones with an azaheterocyclic fused ring CIBA-GEIGY AG (CH) 1996-04-10 EP disclosed
US-4911750-A Mixture of a 1,2,4-triazole and phosphorus compound BAYER AKTIENGESELLSCHAFT (DE) 1990-03-27 US disclosed
US-4570014-A Cycloalkanecarboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1986-02-11 US disclosed
US-4554017-A Method and compositions for regulating plant growth using cycloalkane-carboxylic acid compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-11-19 US disclosed
US-4452625-A 1,2,4-TETRAZOLE COMPOUND WITH A CYCLOPROPANE CARBOXY COMPOUND BAYER AKTIENGESELLSCHAFT (DE) 1984-06-05 US disclosed