SCHEMBL29415027

SCHEMBL29415027

Cc1cc(-c2ccc(/N=N/c3cc(N)c4ccccc4c3S(=O)(=O)O)c(C)c2)ccc1/N=N/c1cc(N)c2ccccc2c1S(=O)(=O)O.[Na]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.51
▸ THRB P10828 3/20 0.51
▸ HPGD P15428 3/20 0.51
▸ RECQL P46063 3/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ ALOX15 P16050 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ ALOX12 P18054 2/20 0.51
▸ ENPP2 Q13822 2/20 0.49
▸ PHLPP2 Q6ZVD8 2/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ APP P05067 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ SNCA P37840 2/20 0.49
▸ BLM P54132 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ TP53 P04637 1/20 0.49

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
SCHEMBL30853487 0.85 SENP2 (0.50) ALDH1A1THRBHPGDRECQLMAPK1
SCHEMBL30508532 0.85 THRB (0.63) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL31252510 0.83 APP (0.59) ALDH1A1THRBHPGDRECQLHSD17B10
SCHEMBL23787668 0.82 THRB (0.57) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL23787775 0.80 ALDH1A1 (0.55) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL23787634 0.79 ALDH1A1 (0.56) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL23787577 0.76 ALDH1A1 (0.65) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL11922531 0.76 SENP2 (0.79) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL19154084 0.76 SENP2 (0.79) ALDH1A1THRBHPGDRECQLCYP3A4
SCHEMBL29415045 0.74 ALDH1A1 (0.51) ALDH1A1THRBHPGDRECQLCYP3A4

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-119285886-A Method for producing optical material, and polymerizable composition for optical material 三井化学株式会社 2025-01-10 — — CN disclosed
CN-110291122-B Polymerizable composition for optical material, optical material obtained from the composition, and plastic lens 三井化学株式会社 2022-03-01 — — CN disclosed
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