SCHEMBL13899602

SCHEMBL13899602

Bc1c(C)c(C)cc(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL27900088 0.97 CYP3A4 (0.32) CYP3A4TSHRMAPK1
Water SCHEMBL27698476 0.97 CYP3A4 (0.32) CYP3A4TSHRMAPK1
SCHEMBL22317804 0.80 CYP3A4 (0.30) CYP3A4TSHRMAPK1
SCHEMBL20901520 0.80 CA1 (0.43) TSHR
SCHEMBL18466697 0.79 CYP3A4 (0.33) CYP3A4TSHRMAPK1
SCHEMBL25676191 0.76 POLB (0.30)
SCHEMBL21360879 0.74 CYP3A4 (0.35) CYP3A4TSHRMAPK1
SCHEMBL120101 0.72 TSHR (0.39) CYP3A4TSHRMAPK1
SCHEMBL20901526 0.72 ALDH1A1 (0.31) TSHR
SCHEMBL13547710 0.71 RAPGEF4 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200251662-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY PANEL Wuhan China Star Optoelectronics Semicondutor Display Technology Co., Ltd. (CN) 2020-08-06 US disclosed
EP-3127988-B1 ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2018-03-14 EP disclosed
CN-102391268-A Photobase generator containing alkoxy bicyclic guanidine and preparation method and use thereof UNIV SHANDONG 2012-03-28 CN disclosed
CN-102338985-A Environment-friendly type photosensitive resist for hydroxyl-containing hydrocarbyl bicyclic guanidine senecionine generation agent UNIV SHANDONG 2012-02-01 CN disclosed
CN-102295646-A Photobase generating agent containing unsaturated alkyl bicyclic guanidine and preparation method and application thereof 2011-12-28 CN disclosed
CN-102285989-A Bicyclic guanidine senecionine generating agent containing alkane and preparation method and application thereof 2011-12-21 CN disclosed
CN-102285990-A Photo-alkali-generator for alkyl bicyclo guanidine having hydroxyl and preparation method and use thereof 2011-12-21 CN disclosed
CN-102279523-A Photoresist composition UNIV SHANDONG 2011-12-14 CN disclosed
CN-102279525-A Low-pollution photoresist composition UNIV SHANDONG 2011-12-14 CN disclosed
CN-102279524-A Environment-friendly photoresist composition UNIV SHANDONG 2011-12-14 CN disclosed
US-7504397-B2 mTOR inhibitor compounds KUDOS PHARMACEUTICALS LTD. (GB) 2009-03-17 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-20200251662-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY PANEL TEAD2, TEAD1, TEAD3 CYP3A4 557/4885TSHR 4062/4885MAPK1 1537/4885

“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.