SCHEMBL2448089

SCHEMBL2448089

[c]1ccc(-c2cccc(-c3cccc(-c4ccccc4)c3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.48
ALDH1A1 P00352 1/20 0.47
KMO O15229 1/20 0.46
ACMSD Q8TDX5 2/20 0.45
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
KMT2A Q03164 1/20 0.44
NISCH Q9Y2I1 1/20 0.44
MGLL Q99685 2/20 0.43
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
ALOX5 P09917 1/20 0.41
GP6 Q9HCN6 1/20 0.41
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
DHFR P00374 1/20 0.39
HNF4A P41235 1/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL23957 1.00 MAOA (0.48) MAOAALDH1A1KMOACMSDMEN1
SCHEMBL11973522 0.95 MEN1 (0.48) MAOAALDH1A1KMOACMSDMEN1
SCHEMBL2451112 0.92 ALDH1A1 (0.50) MAOAALDH1A1KMOACMSDMEN1
SCHEMBL2576 0.89 ALDH1A1 (0.60) MAOAALDH1A1MGLLALOX5CYP3A4
SCHEMBL9334552 0.86 ALDH1A1 (0.56) ALDH1A1ACMSDNISCHMGLLALOX5
SCHEMBL3886287 0.86 ALDH1A1 (0.56) MAOAALDH1A1MGLLALOX5CYP3A4
Hydrochloric Acid SCHEMBL28609394 0.86 ALDH1A1 (0.56) MAOAALDH1A1MGLLAGXTCYP3A4
SCHEMBL2448872 0.86 ALDH1A1 (0.56) ALDH1A1ACMSDNISCHMGLLALOX5
SCHEMBL25683 0.86 ALDH1A1 (0.56) ALDH1A1ACMSDNISCHMGLLALOX5
SCHEMBL28993681 0.86 ALDH1A1 (0.56) MAOAALDH1A1MGLLALOX5CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1640430-B1 Luminescent material and organic electroluminescent device using the same JNC CORP (JP) 2011-09-21 EP disclosed
EP-2177586-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2010-04-21 EP disclosed
US-20100025661-A1 Luminescent material and organic electroluminescent device using the same JNC CORPORATION (JP) 2010-02-04 US disclosed
EP-1640430-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2006-03-29 EP disclosed
US-20060014046-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2006-01-19 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-20060014046-A1 Luminescent material and organic electroluminescent device using the same C1S, EPB41, EPB41L2 MAOA 1418/4885ALDH1A1 1227/4885KMO 2313/4885
US-20100025661-A1 Luminescent material and organic electroluminescent device using the same TRPV3, TRPC3, HVCN1 MAOA 2468/4885ALDH1A1 944/4885KMO 1696/4885

“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.