SCHEMBL22328865

SCHEMBL22328865

Fc1ccc(-c2c3c(c(-c4ccc(F)cc4)c4ccccc24)-c2ccc4c5ccc6c7c(ccc(c8ccc-3c2c84)c57)c2c(-c3ccccc3-c3ccccc3)c3cc4ccccc4c4c5ccccc5c(c62)c34)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.38
ENPP1 P22413 2/20 0.37
HPGD P15428 3/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR4A2 P43354 1/20 0.32
PTGS2 P35354 1/20 0.32
GRM2 Q14416 1/20 0.32
TOP1 P11387 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MPI P34949 1/20 0.31
KMT2A Q03164 1/20 0.31
MKNK1 Q9BUB5 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
SCHEMBL13932319 0.88 GPR84 (0.38) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL13932300 0.85 NR4A2 (0.40) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL13932261 0.85 NR4A2 (0.40) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL13932263 0.85 NR4A2 (0.40) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL13932258 0.85 NR4A2 (0.40) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL13932310 0.84 GPR84 (0.39) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL22328891 0.83 MAPT (0.40) HPGDKDM4EHTTNPSR1MEN1
SCHEMBL13932320 0.83 NR4A2 (0.38) GPR84ENPP1HPGDKDM4ECYP1A2
SCHEMBL22328893 0.83 ENPP1 (0.33) ENPP1
SCHEMBL13932260 0.83 NR4A2 (0.41) GPR84ENPP1HPGDKDM4ECYP1A2

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
US-20200255358-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2020-08-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200255358-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CCNL2, MCM4, CCNT1 GPR84 1724/4885ENPP1 4311/4885HPGD 4112/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.