SCHEMBL8973591

SCHEMBL8973591

COc1ccc(S(=O)(=O)c2ccccc2)cc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
TDP1 Q9NUW8 2/20 0.56
KMT2A Q03164 4/20 0.54
MEN1 O00255 1/20 0.54
MAPK1 P28482 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
MAPT P10636 2/20 0.53
S1PR4 O95977 1/20 0.53
S1PR1 P21453 1/20 0.53
RAB9A P51151 1/20 0.53
GFER P55789 1/20 0.53
PAX8 Q06710 1/20 0.53
TSHR P16473 2/20 0.53
POLB P06746 2/20 0.53
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52
TUBA1B P68363 1/20 0.52
TUBA4A P68366 1/20 0.52
TUBB4B P68371 1/20 0.52

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
SCHEMBL2900568 0.88 MAPK1 (0.57) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL13980532 0.81 ALDH1A1 (0.59) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL16797504 0.80 MAPK1 (0.81) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL1186309 0.80 CA12 (0.60) ALDH1A1TDP1KMT2AMEN1NPSR1
SCHEMBL4897543 0.80 ALDH1A1 (0.58) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL11244365 0.80 ALDH1A1 (0.58) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL1371248 0.80 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1MAPTTSHR
SCHEMBL17978495 0.79 FFAR4 (0.66) ALDH1A1TDP1KMT2AMEN1MAPK1
SCHEMBL8046997 0.78 HTR6 (0.69) ALDH1A1KMT2AMEN1MAPK1MAPT
SCHEMBL17373970 0.77 ALDH1A1 (0.56) ALDH1A1TDP1KMT2AMEN1MAPK1

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
EP-0335274-B1 Formation of nitrophenyl ethers from polyols and nitroanisoles DOW CHEMICAL CO (US) 1996-03-13 EP disclosed
US-4960950-A Formation of nitrophenyl ethers from polyols and nitroanisoles THE DOW CHEMICAL COMPANY (US) 1990-10-02 US disclosed
EP-0335274-A2 Formation of nitrophenyl ethers from polyols and nitroanisoles THE DOW CHEMICAL COMPANY (US) 1989-10-04 EP disclosed