SCHEMBL9847576

SCHEMBL9847576

CCOC1(C)CC(C)(C)c2ccc(Oc3ccc(NC(=O)N(C)OC)cc3)cc2O1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
PKM P14618 1/20 0.40
NPY5R Q15761 3/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MTNR1B P49286 6/20 0.35
MTNR1A P48039 4/20 0.35
NPC1 O15118 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
ALOX5 P09917 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
SCHEMBL9847560 0.93 MEN1 (0.38) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL67099 0.90 MEN1 (0.43) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL29390499 0.90 MEN1 (0.43) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL9847651 0.87 MEN1 (0.40) MEN1KMT2ARAB9ATDP1PKM
Metobromuron SCHEMBL15994323 0.86 KMT2A (0.52) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL9847637 0.85 MTNR1B (0.38) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL9847645 0.85 PPARA (0.40) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL27592441 0.79 MEN1 (0.43) MEN1KMT2ARAB9ATDP1PKM
SCHEMBL9847569 0.78 MTNR1B (0.37) MEN1KMT2ARAB9ATDP1ALDH1A1
SCHEMBL9847543 0.77 ALDH1A1 (0.42) MEN1KMT2ARAB9ATDP1ALDH1A1

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-0434074-A2 Process for the production of 1-lower alkoxy-1-lower alkyl-3-substituted phenylurea, and intermediate thereof and process for the production of the intermediate MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-06-26 EP disclosed