SCHEMBL29237183

SCHEMBL29237183

O=Cc1cc(Cl)cc(Br)n1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 3/20 0.38
TERT O14746 3/20 0.35
CCR1 P32246 1/20 0.32
S1PR4 O95977 2/20 0.32
TDP1 Q9NUW8 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL4595138 0.84 ERN1 (0.42) ERN1TERTCCR1S1PR4TDP1
SCHEMBL1572837 0.77 ERN1 (0.38) ERN1TERTCCR1S1PR4TDP1
SCHEMBL29945725 0.77 ERN1 (0.38) ERN1TERTCCR1S1PR4TDP1
SCHEMBL9772995 0.77 CCR1 (0.34) ERN1TERTCCR1
SCHEMBL29589485 0.77 CCR1 (0.34) ERN1TERTCCR1
Dimethylamine SCHEMBL9637800 0.76 ERN1 (0.37) ERN1TERTCCR1S1PR4TDP1
SCHEMBL1817990 0.75
SCHEMBL23580086 0.74 ERN1 (0.35) ERN1TERTCCR1S1PR4TDP1
SCHEMBL30044498 0.74 ERN1 (0.35) ERN1TERTCCR1S1PR4TDP1
SCHEMBL29956511 0.74 HTR6 (0.36) CCR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117730861-A Fluopicolide-avermectin microcapsule suspension-suspension agent and preparation method thereof 青岛海纳生物科技有限公司 2024-03-22 CN claimed
CN-117730861-A Fluopicolide-avermectin microcapsule suspension-suspension agent and preparation method thereof 青岛海纳生物科技有限公司 2024-03-22 CN disclosed
CN-117730861-A Fluopicolide-avermectin microcapsule suspension-suspension agent and preparation method thereof 青岛海纳生物科技有限公司 2024-03-22 CN disclosed