SCHEMBL9620548

SCHEMBL9620548

COCCOC(=O)c1c(F)cccc1S(=O)(=O)N=C=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.40
▸ ALOX15 P16050 1/20 0.36
▸ KAT6A Q92794 6/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ ADRB2 P07550 1/20 0.35
▸ ADRB1 P08588 1/20 0.35
▸ ADRB3 P13945 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ THRB P10828 1/20 0.33

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
SCHEMBL9620596 0.85 CA1 (0.40) TSHRKAT6AKMT2ACA1CA2
SCHEMBL9136969 0.72 CA12 (0.44) TSHRCA1CA2LMNAALDH1A1
SCHEMBL7025962 0.70 ALDH1A1 (0.49) TSHRKAT6ALMNAALDH1A1TP53
SCHEMBL9620517 0.69 CA1 (0.40) TSHRKMT2ACA1CA2LMNA
SCHEMBL9139851 0.69 CA1 (0.40) TSHRKMT2ACA1CA2ALDH1A1
SCHEMBL31259921 0.69 NFE2L2 (0.38) KAT6AKMT2AALDH1A1
SCHEMBL5268908 0.69 NFE2L2 (0.38) KAT6AKMT2AALDH1A1
SCHEMBL11092403 0.69 AR (0.36) TSHRCA2ADRB2LMNAALDH1A1
SCHEMBL11111735 0.69 ALDH1A1 (0.58) TSHRCA1CA2LMNAALDH1A1
SCHEMBL9620878 0.69 MAPT (0.48) ALDH1A1SMN1; SMN2

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-5104441-A HERBICIDAL SULFONAMIDES AND THEIR USE TO INFLUENCE PLANT GROWTH BASF AKTIENGESELLSCHAFT (DE) 1992-04-14 — — US disclosed
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