SCHEMBL27323918

SCHEMBL27323918

O=Cc1ccc(S(=O)(=O)Oc2ccccc2)cc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
ALPL P05186 1/20 0.43
ALPI P09923 1/20 0.43
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HPGD P15428 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GPR17 Q13304 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL29047554 0.90 ALDH1A1 (0.44) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL29047561 0.81 APEX1 (0.53) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL9763811 0.80 KMT2A (0.44) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL10783122 0.80 FFAR4 (0.53) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL7179842 0.80 VCAM1 (0.62) ALPLALPIVCAM1TDP1
SCHEMBL15647681 0.80 MAPT (0.44) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL16856902 0.78 ALDH1A1 (0.47) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL9508889 0.78 ALPL (0.46) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL29047626 0.78 ALDH1A1 (0.46) ALDH1A1ALPLALPIKMT2AMEN1
SCHEMBL29047565 0.78 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1036276-A Make the method for erect image and negative-appearing image with the static main leaf of photo-hardening DU PONT (US) 1989-10-11 CN disclosed