SCHEMBL22197877

SCHEMBL22197877

CC(C)(C)c1c2c(=O)n(-c3ccc(C(F)(F)F)cc3)c(=O)c2c(C(C)(C)C)c2c(=O)n(-c3ccc(C(F)(F)F)cc3)c(=O)c12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
TRPV1 Q8NER1 2/20 0.40
MPI P34949 1/20 0.39
PHOSPHO1 Q8TCT1 1/20 0.39
PTGS2 P35354 3/20 0.38
NR1H4 Q96RI1 2/20 0.38
NPBWR1 P48145 2/20 0.36
CYP1A2 P05177 1/20 0.36
MCHR1 Q99705 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
ATM Q13315 1/20 0.35
GRM5 P41594 1/20 0.34

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
SCHEMBL25965011 0.95 GSK3A (0.44) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL5535450 0.87 GSK3A (0.47) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL17995365 0.87 GSK3A (0.45) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL25599472 0.84 GSK3A (0.43) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL29328204 0.83 GSK3A (0.45) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL5533650 0.77 GSK3A (0.42) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL5531699 0.74 CA12 (0.50) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL5575888 0.73 NPBWR1 (0.43) GSK3AGSK3BTRPV1PTGS2NR1H4
SCHEMBL17537378 0.73 GSK3A (0.59) GSK3AGSK3BTRPV1MPIPHOSPHO1
SCHEMBL5534241 0.69 ADRB1 (0.38) MPIPHOSPHO1NPBWR1CYP1A2MCHR1

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
US-20230209990-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-29 US disclosed
US-20200220088-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-07-09 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 (2 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-20200220088-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES L3MBTL3, AGO2, ELAVL3 GSK3A 3259/4885GSK3B 2484/4885TRPV1 1356/4885
US-20230209990-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES L3MBTL3, AGO2, ELAVL3 GSK3A 3259/4885GSK3B 2484/4885TRPV1 1356/4885

“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.