SCHEMBL11597984

SCHEMBL11597984

O=C(Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12)c1cc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(O)c23)cc([N+](=O)[O-])c1.[Na].[Na].[Na].[Na]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.65
▸ RAB9A P51151 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ MEN1 O00255 7/20 0.46
▸ KMT2A Q03164 7/20 0.46
▸ POLB P06746 1/20 0.45
▸ ALOX5 P09917 3/20 0.44
▸ PABPC1 P11940 1/20 0.43
▸ DUSP3 P51452 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ EIF4H Q15056 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ENPP2 Q13822 1/20 0.42
▸ TIMP3 P35625 1/20 0.42
▸ NT5E P21589 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ HPGD P15428 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
SCHEMBL11429045 0.93 POLB (0.57) APEX1MAPTMEN1KMT2APOLB
SCHEMBL11429040 0.92 POLB (0.56) APEX1MAPTMEN1KMT2APOLB
SCHEMBL8755454 0.89 APEX1 (0.70) APEX1RAB9AMAPTMEN1KMT2A
SCHEMBL10412672 0.89 APEX1 (0.69) APEX1RAB9AMAPTMEN1KMT2A
SCHEMBL11424495 0.88 APEX1 (0.49) APEX1RAB9AMAPTMEN1KMT2A
Lindane SCHEMBL11436245 0.83 APEX1 (0.45) APEX1RAB9AMAPTMEN1KMT2A
SCHEMBL11597795 0.81 APEX1 (0.69) APEX1MAPTMEN1KMT2APOLB
SCHEMBL11433857 0.81 APEX1 (0.58) APEX1RAB9AMAPTMEN1KMT2A
SCHEMBL11433142 0.81 APEX1 (0.56) APEX1RAB9AMAPTMEN1KMT2A
SCHEMBL11436623 0.81 APEX1 (0.58) APEX1RAB9AMAPTMEN1KMT2A

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
US-4129591-A INHIBITORS OF THE COMPLEMENT SYSTEM AMERICAN CYANAMID COMPANY (US) 1978-12-12 — — US disclosed
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