SCHEMBL31152017

SCHEMBL31152017

CCCCCC(I)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)CC(I)CCCCC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.33
MAPT P10636 1/20 0.31
LMNA P02545 1/20 0.31
GPR84 Q9NQS5 4/20 0.31
DNM1 Q05193 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
SCHEMBL30148084 0.94 OPRM1 (0.30) OPRM1
SCHEMBL30148055 0.93 MAPT (0.32) MAPTLMNAGPR84DNM1
SCHEMBL28961457 0.93
SCHEMBL30148048 0.93 MAPT (0.32) MAPTLMNAGPR84DNM1
SCHEMBL14732287 0.91
SCHEMBL9854347 0.91 MAPT (0.31) MAPTLMNAGPR84
SCHEMBL22236971 0.91 MAPT (0.31) MAPTLMNAGPR84
SCHEMBL9854433 0.91 MAPT (0.31) MAPTLMNAGPR84
SCHEMBL17830474 0.91 LMNA (0.38) MAPTLMNAGPR84
SCHEMBL26381273 0.91 OPRM1 (0.32) OPRM1

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-115710157-B Fluorine-containing compound initiated by hindered free radical pair, and preparation method and application thereof 吉林大学 2024-10-18 CN disclosed