SCHEMBL24241978

SCHEMBL24241978

CCCC1(C(=O)OCc2ccccc2)CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPSR1 Q6W5P4 1/20 0.47
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.43
RECQL P46063 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42

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
SCHEMBL23135866 0.84 MEN1 (0.48) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL24241977 0.84 MEN1 (0.50) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL3294615 0.83 KMT2A (0.49) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL22294005 0.83 KMT2A (0.52) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL4816648 0.81 ALDH1A1 (0.44) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL15114589 0.80 KMT2A (0.51) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL5358863 0.80 KMT2A (0.54) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL23897362 0.79 ALDH1A1 (0.45) MEN1KMT2ANPSR1ALDH1A1LMNA
SCHEMBL4817295 0.79 KMT2A (0.45) MEN1KMT2ANPSR1DDB1CRBN
SCHEMBL1966881 0.79 KMT2A (0.52) MEN1KMT2ANPSR1DDB1CRBN

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-3728235-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP disclosed