SCHEMBL29212552

SCHEMBL29212552

N#Cc1ccc(CCOCCc2ccc(C#N)c(F)c2F)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
EGLN2 Q96KS0 2/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
HTR2A P28223 1/20 0.30
KCNJ1 P48048 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
SCHEMBL9723274 0.79 AR (0.40) TRPV4EGLN2HTR2AKCNJ1
SCHEMBL6646922 0.76 TRPV4 (0.36) TRPV4EGLN2KDM4EMEN1ALDH1A1
SCHEMBL9723171 0.75 TYR (0.41) MEN1ALDH1A1HPGDKMT2A
SCHEMBL24108203 0.75 CYP11B1 (0.37) TRPV4FFAR4EGLN2ALDH1A1HPGD
SCHEMBL20607571 0.75 CYP11B1 (0.37) TRPV4EGLN2MAOAMAOB
SCHEMBL9723151 0.75 AR (0.37) TRPV4EGLN2KDM4EHPGDMAOA
SCHEMBL16428424 0.75 TRPV4 (0.35) TRPV4EGLN2MAOAMAOBKCNJ1
SCHEMBL6651902 0.74 TRPV4 (0.48) TRPV4EGLN2MAOAMAOB
SCHEMBL9723264 0.74 TYR (0.44) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL5963451 0.73 ALDH1A1 (0.35) ALDH1A1KCNJ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118054087-B Electrolyte, electrolyte injection method and lithium metal battery 蜂巢能源科技股份有限公司 2024-07-19 CN claimed
CN-118054087-A Electrolyte, electrolyte injection method and lithium metal battery 蜂巢能源科技股份有限公司 2024-05-17 CN claimed
CN-118054087-B Electrolyte, electrolyte injection method and lithium metal battery 蜂巢能源科技股份有限公司 2024-07-19 CN disclosed
CN-118054087-A Electrolyte, electrolyte injection method and lithium metal battery 蜂巢能源科技股份有限公司 2024-05-17 CN disclosed