SCHEMBL31546660

SCHEMBL31546660

CC(NC(=O)c1cc([N+](=O)[O-])ccc1F)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.63
▸ MEN1 O00255 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ MAPT P10636 3/20 0.63
▸ ALDH1A1 P00352 5/20 0.51
▸ KDM4E B2RXH2 3/20 0.50
▸ HPGD P15428 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ PHGDH O43175 1/20 0.50
▸ CRHBP P24387 1/20 0.50
▸ CRHR2 Q13324 1/20 0.50
▸ NPC1 O15118 2/20 0.49
▸ ROCK2 O75116 1/20 0.48
▸ ROCK1 Q13464 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ HTT P42858 1/20 0.47
▸ GAA P10253 1/20 0.46

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
SCHEMBL31546661 0.89 KMT2A (0.51) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL27656560 0.86 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL27656657 0.86 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL28257375 0.84 LMNA (0.61) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL31546635 0.83 ALDH1A1 (0.64) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL31546624 0.80 LMNA (0.54) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10763104 0.79 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10763115 0.79 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL10768107 0.79 NPC1 (0.65) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL27876824 0.78 LMNA (0.64) LMNAMEN1KMT2AMAPTALDH1A1

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-119899184-A Beta-carboline compound, preparation method thereof and application thereof in resisting Alzheimer disease 中国人民解放军北部战区总医院 2025-04-29 — — CN disclosed
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