SCHEMBL28099376

SCHEMBL28099376

CC1C=C([N+](=O)[O-])CC(C)C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL8626188 0.68 ACHE (0.33) MAPTALDH1A1LMNAPOLB
SCHEMBL9909113 0.64
Formaldehyde SCHEMBL27956974 0.64 ALDH1A1 (0.34) ALDH1A1LMNAPOLB
SCHEMBL19062252 0.63 ALDH1A1 (0.31) ALDH1A1POLB
SCHEMBL27949322 0.63
SCHEMBL14392214 0.55 LMNA (0.33) MAPTALDH1A1LMNA
SCHEMBL8602719 0.54
SCHEMBL9719333 0.54
SCHEMBL16173997 0.53
SCHEMBL9921594 0.53 ALDH1A1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820236-A Histone acetyltransferase small molecule inhibitor and preparation method and application thereof 复旦大学 2024-04-05 CN disclosed
CN-105873919-A Substituted uracils as chymase inhibitors 拜耳医药股份有限公司 2016-08-17 CN disclosed