SCHEMBL30880400

SCHEMBL30880400

CCC(=O)N1Cc2ccccc2C(c2cnn(C)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 9/20 0.42
▸ SLC6A4 P31645 9/20 0.42
▸ SLC6A3 Q01959 9/20 0.42
▸ NTRK1 P04629 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ NAMPT P43490 4/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL22461451 0.84 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1
SCHEMBL22461452 0.84 SLC6A2 (0.56) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1
SCHEMBL27392450 0.83 ALDH1A1 (0.39) SLC6A2SLC6A4SLC6A3HSD11B1NAMPT
SCHEMBL27393732 0.82 NAMPT (0.51) NAMPT
SCHEMBL27392457 0.82 PKM (0.40) SLC6A2SLC6A4SLC6A3ALDH1A1LMNA
SCHEMBL24726841 0.81 MAPK1 (0.46) SLC6A2SLC6A4SLC6A3NAMPTLMNA
SCHEMBL30781978 0.81 MAPK1 (0.46) SLC6A2SLC6A4SLC6A3NAMPTLMNA
SCHEMBL30880374 0.80 FSCN1 (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL31711333 0.78 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3HSD11B1NAMPT
SCHEMBL31711252 0.78 NPSR1 (0.46) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1

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
EP-4626876-A1 MICROBIOCIDAL TETRAHYDROISOQUINOLINE DERIVATIVES Syngenta Crop Protection AG (CH) 2025-10-08 — — EP disclosed
WO-2024115509-A1 MICROBIOCIDAL TETRAHYDROISOQUINOLINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-06-06 — — WO disclosed
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