SCHEMBL9092967

SCHEMBL9092967

O=C(O)/C(=C\NO[SiH3])C(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ CTSD P07339 1/20 0.44
▸ TDP1 Q9NUW8 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HPGD P15428 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ GAA P10253 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ ALPL P05186 1/20 0.39
▸ NCOA1 Q15788 1/20 0.39

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
SCHEMBL9092971 1.00 ALDH1A1 (0.47) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL9744912 0.79 ALDH1A1 (0.47) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL1694617 0.75 ALDH1A1 (0.61) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL15180828 0.75 ALDH1A1 (0.61) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL13417526 0.73 ALDH1A1 (0.51) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL10613860 0.73 ALDH1A1 (0.68) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL9092970 0.70 ALDH1A1 (0.46) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL9764926 0.69 ALDH1A1 (0.63) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL2706439 0.69 ALDH1A1 (0.59) ALDH1A1CTSDTDP1MEN1KMT2A
SCHEMBL10863410 0.69 ALDH1A1 (0.51) ALDH1A1CTSDTDP1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516927-A 2-nitrobenzoyl-3-silyloxyaminoacrylate derivatives and method for the preparation of the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1996-05-14 — — US claimed
US-5516927-A 2-nitrobenzoyl-3-silyloxyaminoacrylate derivatives and method for the preparation of the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1996-05-14 — — US disclosed
US-5516927-A 2-nitrobenzoyl-3-silyloxyaminoacrylate derivatives and method for the preparation of the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1996-05-14 — — US disclosed
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