SCHEMBL24614933

SCHEMBL24614933

CC(C)(C)c1ccc2c(-c3cc4ccc5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc3c(-c3ccccc3)c2c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
KIF11 P52732 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
PTPN1 P18031 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
SCHEMBL24614705 0.92 TNKS (0.41) TNKSTNKS2GPR84PTPN1
SCHEMBL24614697 0.90 TNKS (0.33) TNKSTNKS2KIF11PTPN1
SCHEMBL24614701 0.88 PTPN1 (0.37) TNKSTNKS2PTPN1
SCHEMBL24614725 0.87 PTPN1 (0.36) TNKSTNKS2PTPN1
SCHEMBL24614928 0.86 LIMK1 (0.36) TNKSTNKS2PTPN1
SCHEMBL24614807 0.86 TNKS (0.43) TNKSTNKS2KIF11GPR84PTPN1
SCHEMBL24614722 0.86 PTPN1 (0.36) TNKSTNKS2PTPN1
SCHEMBL24614812 0.84 TNKS (0.35) TNKSTNKS2KIF11GPR84PTPN1
SCHEMBL24614702 0.84 PTPN1 (0.34) TNKSTNKS2PTPN1
SCHEMBL24614710 0.82 PTPN1 (0.38) TNKSTNKS2PTPN1

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-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-07-14 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-20220223801-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES TMEM109, PIEZO1, L1CAM TNKS 3531/4885TNKS2 3941/4885KIF11 1984/4885

“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.