SCHEMBL28827352

SCHEMBL28827352

COc1cc2cc(CC(C)(C)C)ccc2cc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.39
HTR2A P28223 7/20 0.38
HTT P42858 1/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
NR3C1 P04150 1/20 0.37
AXL P30530 1/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
CYP19A1 P11511 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CASR P41180 1/20 0.35
HTR2C P28335 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35

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
SCHEMBL13547950 0.82 CA2 (0.42) HTR2AHTTMAPTKDM4EALDH1A1
SCHEMBL12775643 0.82 HTT (0.53) HTTMAPTKDM4EALDH1A1GAA
SCHEMBL28827356 0.77 CYP1A2 (0.52) MMP1MMP9MMP13MAPTKDM4E
SCHEMBL14281441 0.76 PTGS1 (0.54) MMP1MMP9MMP13MAPTKDM4E
SCHEMBL17913390 0.75 AXL (0.53) HTR2AAXLMAPTALDH1A1L3MBTL1
SCHEMBL30081128 0.75 AXL (0.53) HTR2AAXLMAPTALDH1A1L3MBTL1
SCHEMBL17813001 0.75 AXL (0.53) HTR2AAXLMAPTALDH1A1L3MBTL1
SCHEMBL23643815 0.74 CYP1A2 (0.52) HTR2AAXLMAPTKDM4EALDH1A1
SCHEMBL29732501 0.74 CYP1A2 (0.52) HTR2AAXLMAPTKDM4EALDH1A1
SCHEMBL17236365 0.74 KDM4E (0.47) MMP1MMP9MMP13MAPTKDM4E

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-20220285631-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-09-08 US disclosed
CN-114957338-A Organic electroluminescent material and device 环球展览公司 2022-08-30 CN 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-20220285631-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES XDH, CNKSR1, RER1 PTPN1 2191/4885HTR2A 4596/4885HTT 4116/4885

“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.