SCHEMBL11840971

SCHEMBL11840971

Cc1ccc(Nc2c([N+](=O)[O-])cc(C(=O)O)cc2S(N)(=O)=O)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ KMT2A Q03164 6/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ HCAR3 P49019 4/20 0.43
▸ LMNA P02545 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ SMN1; SMN2 Q16637 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
SCHEMBL11842255 0.88 MEN1 (0.54) MAPTKMT2AMEN1TDP1CYP1A2
SCHEMBL11843965 0.85 MAPT (0.51) MAPTKMT2AMEN1POLBHCAR3
SCHEMBL11854950 0.83 L3MBTL1 (0.48) MAPTKMT2AMEN1HPGDNPSR1
SCHEMBL11839665 0.83 MAPT (0.52) MAPTKMT2AMEN1TDP1HPGD
SCHEMBL2883308 0.79 HCAR3 (0.55) MAPTKMT2AMEN1TDP1POLB
SCHEMBL11849602 0.79 MAPT (0.51) MAPTKMT2AMEN1TDP1HCAR3
SCHEMBL11842723 0.79 MAPT (0.63) MAPTKMT2AMEN1HPGDL3MBTL1
SCHEMBL11836594 0.77 KMT2A (0.46) MAPTKMT2AMEN1TDP1POLB
SCHEMBL11783509 0.77 MAPT (0.60) MAPTKMT2AMEN1CYP1A2CYP2C19
SCHEMBL11844621 0.77 MEN1 (0.46) MAPTKMT2AMEN1TDP1HPGD

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-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 — — US disclosed
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