SCHEMBL30607181

SCHEMBL30607181

O=C(c1ccccc1S(=O)(=O)C1CCC1)N1CCN(c2nc3ccc(F)cc3s2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 18/20 1.00
TP53 P04637 2/20 0.60
MAPT P10636 1/20 0.60
LMNA P02545 1/20 0.59

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
SCHEMBL19630537 1.00 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL21050112 0.98 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL19617804 0.97 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL30607198 0.97 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL19630607 0.96 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL30607207 0.96 NAAA (1.00) NAAATP53MAPTLMNA
SCHEMBL19630612 0.92 NAAA (0.88) NAAATP53MAPTLMNA
SCHEMBL19630620 0.92 NAAA (0.88) NAAATP53MAPT
SCHEMBL19630606 0.90 NAAA (1.00) NAAATP53MAPT
SCHEMBL26835010 0.89 NAAA (0.80) NAAATP53MAPT

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-109476616-B Piperazinyl methanone NAAA inhibitors 加利福尼亚大学董事会 2023-10-13 CN disclosed