SCHEMBL31424239

SCHEMBL31424239

CN1C(=O)C(Cc2ccc(F)cc2)C(=O)N(C)C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.62
MAPT P10636 9/20 0.62
HSD17B10 Q99714 7/20 0.62
KMT2A Q03164 5/20 0.62
GAA P10253 5/20 0.62
MEN1 O00255 4/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
THRB P10828 2/20 0.62
RECQL P46063 1/20 0.62
KDM4C Q9H3R0 4/20 0.59
POLB P06746 3/20 0.59
KDM4A O75164 2/20 0.59
USP2 O75604 2/20 0.59
ALOX15 P16050 1/20 0.59
CACNA1B Q00975 1/20 0.56
APBA1 Q02410 1/20 0.56
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
CES2 O00748 1/20 0.43
EP300 Q09472 1/20 0.41

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
SCHEMBL17717914 0.91 ALDH1A1 (0.72) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL15978256 0.82 ALDH1A1 (0.62) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL17294178 0.82 ALDH1A1 (0.62) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL4435666 0.81 KMT2A (0.72) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL17358747 0.79 KMT2A (0.65) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL17294179 0.79 L3MBTL1 (0.68) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL8344423 0.78 GAA (0.41) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL8343346 0.78 GAA (0.41) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL31006368 0.77 ALDH1A1 (1.00) ALDH1A1MAPTHSD17B10KMT2AGAA
SCHEMBL15978122 0.76 MAPT (0.60) ALDH1A1MAPTHSD17B10KMT2AGAA

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
CN-119735614-A 1-Phosphanorbornene-dimethyl xanthene chiral ligand and synthetic method and application thereof 河南工业大学 2025-04-01 CN disclosed
CN-119431387-A Spirobarbituric acid-epoxyhexane compound and synthetic method and application thereof 河南工业大学 2025-02-14 CN disclosed