SCHEMBL8669765

SCHEMBL8669765

CC=CC=CC(C(N)=O)C(N)=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 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
SCHEMBL13742840 0.81 LMNA (0.32)
SCHEMBL11119968 0.77 GRIK1 (0.35) ALDH1A1GRIK1GRIK2
SCHEMBL18168718 0.77 GRIK1 (0.35) ALDH1A1GRIK1GRIK2
SCHEMBL18168693 0.71 SMN1; SMN2 (0.36)
SCHEMBL18168695 0.71 SMN1; SMN2 (0.36)
SCHEMBL16754663 0.71 CA2 (0.43) ALDH1A1
SCHEMBL20550607 0.69 FPR2 (0.39) ALDH1A1
Hydrochloric Acid SCHEMBL20550683 0.69 CA2 (0.42) ALDH1A1
SCHEMBL20550608 0.69 FPR2 (0.39) ALDH1A1
Hydrochloric Acid SCHEMBL20550684 0.69 CA2 (0.42) ALDH1A1

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-0767804-B1 POLYMERIZATION PROCESS USING DIENE CONTAINING CATALYSTS DOW CHEMICAL CO (US) 1998-12-09 EP disclosed