SCHEMBL31496845

SCHEMBL31496845

O=C(O)N1CC2(CC2)Oc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.43
HSD17B3 P37058 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.37
SIRT3 Q9NTG7 1/20 0.36
P2RX4 Q99571 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
SCHEMBL30752994 0.83 ADORA1 (0.44) P2RX4
SCHEMBL30752887 0.82 KDM1A (0.46) NOTUMHSD17B3P2RX4
SCHEMBL31318504 0.79 SLC22A12 (0.42) NOTUMHSD17B3SIRT3
SCHEMBL31318560 0.78 SIRT3 (0.41) SIRT3
SCHEMBL31318523 0.76 SLC22A12 (0.44) SIRT3
SCHEMBL31318539 0.76 SLC22A12 (0.50) SIRT3P2RX4
SCHEMBL31318516 0.76 SLC22A12 (0.43) SIRT3
SCHEMBL31318493 0.75 LMNA (0.42) SIRT3
SCHEMBL31318544 0.75 SIRT3 (0.41) SIRT3
SCHEMBL31318517 0.75 SIRT3 (0.41) SIRT3

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-119585261-A PRMT5 inhibitor, preparation method and application thereof 上海艾力斯医药科技股份有限公司 2025-03-07 CN disclosed