SCHEMBL8155665

SCHEMBL8155665

Fc1cccc(Cl)c1N=S

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GAA P10253 3/20 0.38
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2A6 P11509 1/20 0.35
HTT P42858 3/20 0.33
LMNA P02545 2/20 0.33
BACE1 P56817 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2A13 Q16696 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
SCHEMBL10820270 0.83 CES2 (0.36) ALDH1A1
SCHEMBL21519520 0.83 CYP1A2 (0.43) TAAR1MEN1KMT2ACYP1A2TDP1
SCHEMBL10387393 0.77 MEN1 (0.43) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL29812934 0.77 GABRA1 (0.46) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL158972 0.77 GABRA1 (0.46) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL1950281 0.72 GABRA1 (0.47) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL29648809 0.72 GABRA1 (0.47) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL11884432 0.72 HTR3E (0.48) TAAR1MEN1KMT2AGAACYP2C9
SCHEMBL8097830 0.72 TAAR1 (0.37) TAAR1MEN1KMT2AGAACYP1A2
SCHEMBL27214923 0.70 MEN1 (0.44) TAAR1MEN1KMT2AGAACYP1A2

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
EP-0888297-B1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 2000-08-30 EP disclosed