SCHEMBL29828811

SCHEMBL29828811

Clc1cccc2c1oc1cc(-c3ccccc3)cc(-c3ccccc3)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.56
TTR P02766 4/20 0.40
CYP2A6 P11509 1/20 0.38
PIM1 P11309 1/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
CTRC Q99895 1/20 0.35
MAP1LC3B Q9GZQ8 1/20 0.35
CCNC P24863 1/20 0.35
CDK8 P49336 1/20 0.35
ALDH1A1 P00352 2/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
CDC14B O60729 1/20 0.33
CDC14A Q9UNH5 1/20 0.33
WEE1 P30291 1/20 0.33
MAPT P10636 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
SCHEMBL22708939 0.86 AHR (0.61) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL26254534 0.85 AHR (0.51) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL22763998 0.84 AHR (0.54) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL24210574 0.84 AHR (0.50) AHRCYP2A6PIM1CSNK2A2CSNK2B
SCHEMBL25568102 0.82 AHR (0.51) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL26234623 0.81 AHR (0.43) AHRTTRPIM1CSNK2A2CSNK2B
SCHEMBL24518923 0.80 AHR (0.53) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL23098344 0.79 TSHR (0.38) AHRPIM1CSNK2A2CSNK2BPIM3
SCHEMBL23098312 0.79 AHR (0.53) AHRTTRCYP2A6PIM1CSNK2A2
SCHEMBL27050600 0.78 CYP1A1 (0.47) AHRCSNK2A2CSNK2BALDH1A1TSHR

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-20220255020-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-08-11 US disclosed
CN-114853745-A Organic electroluminescent material and device 环球展览公司 2022-08-05 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-20220255020-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, CHRM1 AHR 220/4885TTR 2924/4885CYP2A6 2201/4885

“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.