SCHEMBL11116874

SCHEMBL11116874

CON(C)C(=O)Nc1cc(CC(C)C)ns1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.33
NPY5R Q15761 4/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31
CXCR1 P25024 1/20 0.31
CXCR2 P25025 1/20 0.31
PRMT3 O60678 1/20 0.31
GAA P10253 2/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL11120393 0.86 MEN1 (0.40) MEN1KMT2ATDP1PKMRAB9A
SCHEMBL11120296 0.86 TSHR (0.36) MEN1KMT2ARAB9ATSHRALDH1A1
SCHEMBL11122089 0.84 MEN1 (0.38) MEN1KMT2ATDP1PKMRAB9A
SCHEMBL11120094 0.83 TSHR (0.35) MEN1KMT2ARAB9ATSHRNPY5R
Water SCHEMBL11122287 0.82 TSHR (0.34) MEN1KMT2ARAB9ATSHRNPY5R
SCHEMBL11119079 0.82 MEN1 (0.37) MEN1KMT2ATDP1PKMRAB9A
SCHEMBL11116736 0.81 MEN1 (0.40) FAAHMEN1KMT2ATDP1PKM
SCHEMBL11120103 0.80 NPY5R (0.45) TSHRNPY5R
SCHEMBL11123858 0.80 HDAC3 (0.37) TSHRMAPTGAA
SCHEMBL11118646 0.79 MEN1 (0.37) FAAHMEN1KMT2ATDP1PKM

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
EP-0129408-A2 (3-alkyl-5-isothiazolyl)ureas ELI LILLY AND COMPANY (US) 1984-12-27 EP claimed
EP-0129408-A2 (3-alkyl-5-isothiazolyl)ureas ELI LILLY AND COMPANY (US) 1984-12-27 EP disclosed