SCHEMBL13761076

SCHEMBL13761076

Cc1sc(-c2ccccc2)nc1C1=C(OC(=O)N(C)C)CC(C)(C)NC1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RARA P10276 4/20 0.42
▸ RARB P10826 4/20 0.42
▸ RARG P13631 4/20 0.42
▸ HRH3 Q9Y5N1 3/20 0.39
▸ CDC7 O00311 2/20 0.35
▸ DBF4 Q9UBU7 2/20 0.35
▸ ALOX5 P09917 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NLRP1 Q9C000 1/20 0.34
▸ TRPM8 Q7Z2W7 1/20 0.34
▸ TSPO P30536 1/20 0.34
▸ ATP4A P20648 1/20 0.33
▸ ATP4B P51164 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ADAMTS5 Q9UNA0 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
SCHEMBL13710203 0.84 RARA (0.43) RARARARBRARGHRH3CDC7
SCHEMBL13761054 0.82 RARA (0.47) RARARARBRARGHRH3CDC7
SCHEMBL13765964 0.81 RARA (0.43) RARARARBRARGHRH3CDC7
SCHEMBL13761056 0.80 RARA (0.46) RARARARBRARGHRH3KDM4E
SCHEMBL13761086 0.77 MAPT (0.44) RARARARBRARGHRH3CDC7
SCHEMBL13761081 0.77 MAPT (0.38) RARARARBRARGHRH3KDM4E
SCHEMBL13761051 0.77 HRH3 (0.40) RARARARBRARGHRH3KMT2A
SCHEMBL13761083 0.74 HRH3 (0.43) HRH3ALOX5KDM4EALDH1A1
SCHEMBL14506986 0.74 RARA (0.46) RARARARBRARGHRH3CDC7
SCHEMBL13761060 0.73 RARA (0.35) RARARARBRARGKDM4EALDH1A1

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-7566731-B2 Hetaryl substituted homotetramic and homotetronic acids and their use thereof as pesticides BAYER CROPSCIENCE AG (DE) 2009-07-28 — — US disclosed
US-7566731-B2 Hetaryl substituted homotetramic and homotetronic acids and their use thereof as pesticides BAYER CROPSCIENCE AG (DE) 2009-07-28 — — US disclosed
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