SCHEMBL21149175

SCHEMBL21149175

c1ccc2c(c1)cc(-c1nc(-c3cc4ccccc4c4ccccc34)nc(-c3cccc4sc5ccccc5c34)n1)c1ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 4/20 0.45
HIF1A Q16665 3/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 2/20 0.45
CASP1 P29466 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GPR3 P46089 1/20 0.38
CYP11B1 P15538 1/20 0.36
BRDT Q58F21 1/20 0.36
MAPT P10636 4/20 0.35
POLB P06746 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 1/20 0.35
DUSP3 P51452 1/20 0.35
BLM P54132 1/20 0.35
PTPN5 P54829 1/20 0.35
KMT2A Q03164 1/20 0.35
PTPN11 Q06124 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
SCHEMBL21149241 1.00 ALDH1A1 (0.45) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL21149174 0.93 ALDH1A1 (0.40) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL24306441 0.92 L3MBTL1 (0.39) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL21149173 0.91 ALDH1A1 (0.38) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL24307108 0.91 ALDH1A1 (0.38) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL21149247 0.90 L3MBTL1 (0.40) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL21148498 0.90 L3MBTL1 (0.40) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL23283956 0.90 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL24306930 0.90 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10HIF1ATSHR
SCHEMBL24306878 0.90 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10HIF1ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20220123223-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-04-21 US disclosed
US-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-07-11 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 (2 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-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 ALDH1A1 191/4885HPGD 1901/4885HSD17B10 1380/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 ALDH1A1 191/4885HPGD 1901/4885HSD17B10 1380/4885

“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.