SCHEMBL30153402

SCHEMBL30153402

CCCCC=C(C)C(=O)N(NCC)NCC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.35
GRIK1 P39086 1/20 0.33
CCR2 P41597 1/20 0.32
TSHR P16473 1/20 0.31
F7 P08709 1/20 0.31
F3 P13726 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
SCHEMBL29438554 0.89
SCHEMBL30153253 0.84 EP300 (0.36) EP300GRIK1CCR2TSHRF7
SCHEMBL25418175 0.81
SCHEMBL31416613 0.77 ALDH1A1 (0.40) EP300GRIK1CCR2TSHRF7
SCHEMBL28088449 0.76 CA12 (0.38) EP300GRIK1CCR2TSHRF7
SCHEMBL28205531 0.74 CA12 (0.38) EP300GRIK1TSHRF7F3
SCHEMBL1785114 0.72 EP300 (0.45) EP300GRIK1TSHRF7F3
SCHEMBL309931 0.72 EP300 (0.45) EP300GRIK1TSHRF7F3
SCHEMBL29378381 0.72 ALDH1A1 (0.32) GRIK1
SCHEMBL9311791 0.72 ALDH1A1 (0.32) GRIK1

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
CN-111868098-B Method for producing conjugated diene rubber 日本瑞翁株式会社 2022-12-23 CN disclosed