SCHEMBL9092970

SCHEMBL9092970

O=C(C=CNO[SiH3])OC(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.46
▸ CTSD P07339 1/20 0.43
▸ KMT2A Q03164 3/20 0.41
▸ GAA P10253 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALPL P05186 1/20 0.39
▸ TDP1 Q9NUW8 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
SCHEMBL9744500 0.81 ALDH1A1 (0.44) ALDH1A1CTSDKMT2ASMN1; SMN2MAPT
SCHEMBL2289848 0.77 ALDH1A1 (0.61) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL9647951 0.74 ALDH1A1 (0.58) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL7108165 0.74 ALDH1A1 (0.58) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL9647959 0.73 ALDH1A1 (0.56) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL9647969 0.73 ALDH1A1 (0.56) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL1706209 0.71 CTSD (0.56) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL195311 0.71 ALDH1A1 (0.62) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL27562993 0.71 ALDH1A1 (0.54) ALDH1A1CTSDKMT2AGAASMN1; SMN2
SCHEMBL6551442 0.70 ALDH1A1 (0.61) ALDH1A1CTSDKMT2AGAASMN1; SMN2

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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