SCHEMBL11624989

SCHEMBL11624989

Cc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)ccc1Cl.[NaH]

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 8/20 0.75
▸ CA2 P00918 8/20 0.75
▸ CA9 Q16790 4/20 0.68
▸ CA12 O43570 1/20 0.68
▸ MAPT P10636 2/20 0.66
▸ TDP1 Q9NUW8 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ TSHR P16473 1/20 0.64
▸ CA7 P43166 3/20 0.60
▸ CA14 Q9ULX7 2/20 0.60
▸ TP53 P04637 1/20 0.59
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ RXFP1 Q9HBX9 1/20 0.59
▸ POLB P06746 1/20 0.58
▸ USP2 O75604 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.56

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
SCHEMBL30628487 0.81 CA1 (0.86) CA1CA2CA9CA12MAPT
SCHEMBL15888499 0.81 CA1 (0.86) CA1CA2CA9CA12MAPT
SCHEMBL11887649 0.80 CA1 (0.77) CA1CA2CA9CA12TDP1
SCHEMBL15888505 0.78 CA2 (0.74) CA1CA2CA9CA12MAPT
SCHEMBL11624368 0.78 ALDH1A1 (0.53) CA1CA2CA9CA12MAPT
SCHEMBL11807861 0.77 MEN1 (0.87) CA1CA2CA9CA12CA7
SCHEMBL4305965 0.77 CA1 (0.89) CA1CA2CA9CA12MAPT
SCHEMBL11628147 0.77 ALDH1A1 (0.53) CA1CA2MAPTTDP1TSHR
SCHEMBL13401865 0.76 CA1 (0.86) CA1CA2CA9CA12TDP1
SCHEMBL6046379 0.76 MEN1 (0.90) CA1CA2CA9CA12CA7

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-4066639-A BENZENE-SULFONYL SEMICARBAZIDES AND PROCESS FOR PREPARING THEM HOECHST AKTIENGESELLSCHAFT (DT) 1978-01-03 — — US disclosed
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