SCHEMBL18404292

SCHEMBL18404292

C/C=C\C=C/C(=C\C)NC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.33
CNR1 P21554 4/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
CRBN Q96SW2 1/20 0.33
SOAT1 P35610 1/20 0.33
RAB9A P51151 1/20 0.32
TAS2R38 P59533 1/20 0.31

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
SCHEMBL18729443 0.82 CNR2 (0.33) CNR2CNR1PPARGPPARDPPARA
SCHEMBL18950864 0.80 CRBN (0.32) CRBNTAS2R38
SCHEMBL18726662 0.80 CRBN (0.37) CNR2CNR1PPARGPPARDPPARA
SCHEMBL20442301 0.78 CNR2 (0.32) CNR2CNR1PPARGPPARDPPARA
SCHEMBL24247970 0.76 CNR2 (0.33) CNR2CNR1PPARGPPARDPPARA
SCHEMBL14930766 0.76 RAB9A (0.34) CNR2CNR1PPARGPPARDPPARA
SCHEMBL15382252 0.76 TAS2R38 (0.34) CRBNTAS2R38
SCHEMBL18726626 0.75 CNR2 (0.30) CNR2CNR1PPARGPPARDPPARA
SCHEMBL9506629 0.72
SCHEMBL9506631 0.72

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-2439191-B1 METHOD FOR PRODUCING N-SUBSTITUTED CARBAMIC ACID ESTER, METHOD FOR PRODUCING ISOCYANATE USING N-SUBSTITUTED CARBAMIC ACID ESTER, AND COMPOSITION FOR TRANSFERRING AND STORING N-SUBSTITUTED CARBAMIC ACID ESTER CONTAINING N-SUBSTITUTED CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND ASAHI CHEMICAL IND (JP) 2017-01-25 EP disclosed