SCHEMBL29228024

SCHEMBL29228024

CCC(C)(C)C(=O)OOC(N)=O

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.37
LMNA P02545 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL5422387 0.88 CYP4F2 (0.34)
SCHEMBL19821861 0.79 ALDH1A1 (0.35) LMNAHSD17B10
SCHEMBL26980854 0.79 ALOX15 (0.39) ALOX15LMNAHSD17B10
SCHEMBL29222504 0.77
SCHEMBL19821824 0.76 ALDH1A1 (0.32)
SCHEMBL14196625 0.74 TSHR (0.36) HSD17B10
SCHEMBL10040891 0.73
Formic Acid SCHEMBL25287054 0.72 ALOX15 (0.33) ALOX15LMNAHSD17B10
SCHEMBL30661942 0.72 ALDH1A1 (0.33)
SCHEMBL385083 0.72 ALDH1A1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897149-A 3, 4-methylenedioxymethamphetamine and related hallucinogens and uses thereof 人类生物科学股份有限公司 2024-04-16 CN disclosed