SCHEMBL25112893

SCHEMBL25112893

c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4cccc5c6ccccc6c6ccccc6c6cccc3c6c45)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HPGD P15428 5/20 0.44
HSD17B10 Q99714 3/20 0.44
CYP1A2 P05177 2/20 0.44
THRB P10828 1/20 0.44
MAPT P10636 5/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
TSHR P16473 3/20 0.41
KDM4E B2RXH2 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 2/20 0.41
ATM Q13315 2/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
CASP1 P29466 1/20 0.41
HIF1A Q16665 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL25112823 0.95 CYP1A2 (0.47) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL25112949 0.92 ALDH1A1 (0.42) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL16521876 0.87 CYP1A2 (0.46) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL25112980 0.86 ESR1 (0.39) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL17083459 0.86 CYP1A2 (0.49) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL25112899 0.86 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL12144395 0.85 MAPT (0.44) ALDH1A1HPGDHSD17B10CYP1A2MAPT
SCHEMBL25112937 0.84 MEN1 (0.49) ALDH1A1HPGDHSD17B10CYP1A2THRB
SCHEMBL18327468 0.84 CYP11B1 (0.53) ALDH1A1HPGDHSD17B10MAPTL3MBTL1
SCHEMBL19271420 0.84 CYP11B1 (0.53) ALDH1A1HPGDHSD17B10MAPTL3MBTL1

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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 ALDH1A1 192/4885HPGD 3868/4885HSD17B10 3498/4885

“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.