SCHEMBL30096939

SCHEMBL30096939

Cc1cc(NN)ncc1P(C)(C)=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL23833635 1.00 NNMT (0.37) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL3620179 0.74 NOS3 (0.50) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL23833609 0.72 — —
SCHEMBL23832350 0.70 KDM4E (0.42) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL30096938 0.70 KDM4E (0.42) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL24099889 0.69 ALDH1A1 (0.42) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL4751919 0.69 NNMT (0.37) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL20772252 0.69 NNMT (0.37) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL20772266 0.69 NNMT (0.37) NNMTALDH1A1KDM4EGAAMAPT
SCHEMBL23833547 0.68 L3MBTL1 (0.42) NNMTALDH1A1KDM4EGAAMAPT

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
EP-4121426-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND USE Akebia Therapeutics Inc. (US) 2023-01-25 — — EP disclosed
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