SCHEMBL16787239

SCHEMBL16787239

c1ccc(N(c2ccc(-c3cccc4c3Sc3ccccc3S4)cc2)c2cc3ccccc3c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
GPR84 Q9NQS5 1/20 0.33
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL16787172 0.86 ALOX5 (0.36) ALOX5
SCHEMBL17485924 0.85 ALOX5 (0.35) ALOX5
SCHEMBL22671005 0.85 MEN1 (0.40) GPR84ALDH1A1HPGDTSHRMAPK1
SCHEMBL16787151 0.84 ALDH1A1 (0.33) ALOX5ALDH1A1HIF1AHSD17B10
SCHEMBL22671922 0.83 GPR84 (0.40) GPR84ALDH1A1HPGDTSHRMAPK1
SCHEMBL16787199 0.83 ALOX5 (0.35) ALOX5ALDH1A1HPGDTSHRMAPK1
SCHEMBL16787329 0.83 GPR84 (0.30) GPR84
SCHEMBL22671057 0.82 GPR84 (0.41) GPR84ALDH1A1HPGDTSHRMAPK1
SCHEMBL16166382 0.82 ALOX5 (0.44) ALOX5ALDH1A1L3MBTL1
SCHEMBL16166768 0.82 ALOX5 (0.44) ALOX5ALDH1A1L3MBTL1

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-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 US disclosed
US-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 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 (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-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE AOX1, ODC1, OR51E2 ALOX5 344/4885GPR84 2045/4885ALDH1A1 11/4885

“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.