SCHEMBL28049282

SCHEMBL28049282

N#CCCc1cc[c]cc1F

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CDK2 P24941 1/20 0.32
MPO P05164 1/20 0.31
SLC6A4 P31645 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 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
SCHEMBL28049288 0.84 MEN1 (0.36) FFAR1FFAR4MEN1KMT2ACDK2
SCHEMBL21356607 0.82 ALDH1A1 (0.32) FFAR1FFAR4ALDH1A1
SCHEMBL27670907 0.78 TAAR1 (0.30)
SCHEMBL4680155 0.78 PRKCI (0.31)
SCHEMBL4717377 0.76 IDO1 (0.46) FFAR1FFAR4MEN1KMT2AMPO
SCHEMBL1151583 0.75 TAAR1 (0.56) FFAR1FFAR4MEN1KMT2AMPO
SCHEMBL28826926 0.74 MEN1 (0.35) MEN1KMT2A
SCHEMBL7443632 0.74 TYR (0.43) MEN1KMT2A
SCHEMBL596255 0.74
SCHEMBL463162 0.73 TYR (0.43) MEN1KMT2ASLC6A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105375065-A Electrolyte and lithium ion battery containing same NINGDE AMPEREX TECHNOLOGY LTD 2016-03-02 CN disclosed
CN-105261789-A Electrolyte and lithium ion battery including same NINGDE AMPEREX TECHNOLOGY LTD 2016-01-20 CN disclosed