SCHEMBL9599652

SCHEMBL9599652

O=C1C2C=CCCC2C(=O)N1C1=NOc2ccccc2C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 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
SCHEMBL5712943 0.71 MEN1 (0.53) ALDH1A1
SCHEMBL8163464 0.71 ALPL (0.33) ALDH1A1
SCHEMBL9599660 0.68 LMNA (0.32) ALDH1A1
SCHEMBL4395920 0.67 L3MBTL1 (0.44) ALDH1A1
SCHEMBL11035688 0.67 LMNA (0.39) ALDH1A1
SCHEMBL7513082 0.67 GAA (0.40) ALDH1A1
SCHEMBL7227304 0.67 MGLL (0.42) ALDH1A1
SCHEMBL8157105 0.65 USP2 (0.34) —
SCHEMBL7913963 0.65 LMNA (0.38) ALDH1A1
SCHEMBL9568054 0.64 CA9 (0.41) ALDH1A1

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
JP-5345781-A — — None — — JP disclosed
JP-H05345781-A BENZOXAZINE DERIVATIVE SUMITOMO CHEM CO LTD 1993-12-27 — — JP disclosed
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