SCHEMBL9847605

SCHEMBL9847605

CCOC1(C)CCc2ccc(Oc3ccc(N)cc3)cc2O1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
PPARA Q07869 18/20 0.41
PPARG P37231 17/20 0.41
PPARD Q03181 2/20 0.38

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
SCHEMBL9847588 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1PPARAPPARGPPARD
SCHEMBL9847593 0.83 ALDH1A1 (0.42) ALDH1A1MAPK1PPARAPPARGPPARD
SCHEMBL9847583 0.83 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL9749356 0.82 ALDH1A1 (0.48) ALDH1A1MAPK1PPARAPPARGPPARD
SCHEMBL9847543 0.81 ALDH1A1 (0.42) ALDH1A1MAPK1
SCHEMBL9847547 0.80 PPARA (0.42) PPARAPPARGPPARD
SCHEMBL9847551 0.78 PPARG (0.43) ALDH1A1MAPK1PPARAPPARGPPARD
SCHEMBL27889129 0.78 ESR2 (0.42) ALDH1A1PPARA
SCHEMBL9847645 0.77 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL9749678 0.76 ALDH1A1 (0.44) ALDH1A1MAPK1PPARAPPARG

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