SCHEMBL11136284

SCHEMBL11136284

Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.55
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 5/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KCNMA1 Q12791 4/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
RORC P51449 1/20 0.43
HPGD P15428 1/20 0.41

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
SCHEMBL11136276 0.92 APEX1 (0.55) APEX1KMT2AMEN1GAAPOLB
SCHEMBL11514077 0.90 RAB9A (0.44) APEX1KMT2AMEN1GAAPOLB
SCHEMBL11433142 0.88 APEX1 (0.56) APEX1KMT2AMEN1GAAPOLB
SCHEMBL11433134 0.88 APEX1 (0.55) APEX1KMT2AMEN1GAAPOLB
SCHEMBL8755454 0.86 APEX1 (0.70) APEX1KMT2AMEN1MAPTRAB9A
SCHEMBL11587244 0.84 TIMP3 (0.46) KMT2AMEN1GAAPOLBMAPT
SCHEMBL11444026 0.84 TIMP3 (0.46) KMT2AMEN1GAAPOLBMAPT
SCHEMBL11137430 0.83 APEX1 (0.55) APEX1KMT2AMEN1GAAPOLB
SCHEMBL11135640 0.83 APEX1 (0.59) APEX1KMT2AMEN1GAAMAPT
SCHEMBL11589837 0.83 APEX1 (0.59) APEX1KMT2AMEN1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4103028-A SUBSTITUTED HYDROXY NAPHTHALENEDISULFONIC ACIDS AMERICAN CYANAMID COMPANY (US) 1978-07-25 US claimed
US-4391824-A INHIBITING CONNECTIVE TISSUE DISTRUCTION, ENZYME INHIBITORS AMERICAN CYANAMID COMPANY (US) 1983-07-05 US disclosed
US-4127602-A Methyl substituted hydroxynaphthalenesulfonic acid ureides and salts as complement inhibitors AMERICAN CYANAMID COMPANY (US) 1978-11-28 US disclosed
US-4103028-A SUBSTITUTED HYDROXY NAPHTHALENEDISULFONIC ACIDS AMERICAN CYANAMID COMPANY (US) 1978-07-25 US disclosed
US-4046805-A Substituted-hydroxy-naphthalenedisulfonic acid compounds AMERICAN CYANAMID COMPANY (US) 1977-09-06 US disclosed
US-4018764-A IMMUNOLOGY, ANTIBODY INHIBITORS AMERICAN CYANAMID COMPANY (US) 1977-04-19 US disclosed