SCHEMBL9868435

SCHEMBL9868435

CNS(=O)(=O)c1cccc(F)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
GAA P10253 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC40A1 Q9NP59 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL22163647 0.82 PTGS1 (0.33) TSHRSLC40A1SCN1ASCN5ASCN8A
SCHEMBL9378913 0.80 KIF18A (0.47) ALDH1A1ALOX5APFEN1SMN1; SMN2MEN1
SCHEMBL9866654 0.80 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2MEN1KMT2ASLC40A1
SCHEMBL8212123 0.78 SLC40A1 (0.53) L3MBTL1ALDH1A1GAASMN1; SMN2RAB9A
SCHEMBL12319048 0.78 LOX (0.41) ALDH1A1MEN1RAB9AKMT2ALMNA
SCHEMBL9868009 0.77 KEAP1 (0.48) ALDH1A1MEN1KMT2ACA12CA1
SCHEMBL9866452 0.76 ALDH1A1 (0.43) ALDH1A1ALOX5APFEN1GAAKMT2A
SCHEMBL9867995 0.75 KMT2A (0.45) L3MBTL1ALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL9866173 0.75 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2KMT2ACA12CA2
SCHEMBL27345695 0.74 L3MBTL1 (0.36) L3MBTL1ALDH1A1TSHRGAASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987141-A DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-22 US disclosed
EP-0356029-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-28 EP disclosed