SCHEMBL668956

SCHEMBL668956

Oc1cc2ccccc2cc1-c1nc(-c2ccccc2)c(-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.59
ACHE P22303 1/20 0.59
GAA P10253 6/20 0.46
MGAM O43451 5/20 0.46
SI P14410 5/20 0.46
MGAM2 Q2M2H8 5/20 0.46
TOP2A P11388 3/20 0.41
FLT1 P17948 1/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
HSD17B10 Q99714 1/20 0.39
POLB P06746 1/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL667896 0.87 BCHE (0.46) BCHEACHEGAAMGAMSI
SCHEMBL30714861 0.86 BCHE (0.56) BCHEACHEGAAMGAMSI
SCHEMBL668695 0.85 BCHE (0.62) BCHEACHEGAAMGAMSI
SCHEMBL12854018 0.82 BCHE (0.68) BCHEACHEGAAMGAMSI
SCHEMBL28459972 0.81 FABP4 (0.54) BCHEACHEGAAFLT1FLT4
SCHEMBL2475314 0.81 BCHE (0.67) BCHEACHEGAAMGAMSI
SCHEMBL31427634 0.81 BCHE (0.51) BCHEACHEGAAMGAMSI
SCHEMBL31035781 0.80 BCHE (0.56) BCHEACHEGAAMGAMSI
SCHEMBL2173277 0.80 BCHE (0.65) BCHEACHEGAAMGAMSI
SCHEMBL10025663 0.79 BCHE (0.44) BCHEACHEGAAMGAMSI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9106057-B2 White-emitting monomolecular compound using excited-state intramolecular proton transfer, organic electroluminescent element and laser device using the same DONGWOO FINE-CHEM CO. LTD. (KR) 2015-08-11 US disclosed
US-9077155-B2 White-emitting monomolecular compound using excited-state intramolecular proton transfer, organic electroluminescent element and laser device using the same DONGWOO FINE-CHEM CO. LTD. (KR) 2015-07-07 US disclosed
US-9024036-B2 White-emitting monomolecular compound using excited-state intramolecular proton transfer, organic electroluminescent element and laser device using the same DONGWOO FINE-CHEM CO. LTD. (KR) 2015-05-05 US disclosed
CN-102395647-B White light-emitting monomolecular compound utilizing excited intramolecular proton transfer characteristics, and organic electroluminescent element and laser element each comprising same DONGWOO FINE CHEM CO LTD 2014-05-14 CN disclosed
US-20140018543-A1 WHITE-EMITTING MONOMOLECULAR COMPOUND USING EXCITED-STATE INTRAMOLECULAR PROTON TRANSFER, ORGANIC ELECTROLUMINESCENT ELEMENT AND LASER DEVICE USING THE SAME SNU R&DB FOUNDATION (KR) 2014-01-16 US disclosed
US-8569510-B2 White-emitting compounds using excited-state intramolecular proton transfer, organic electroluminescent element and laser material using the same DONGWOO FINE-CHEM CO. LTD. (KR) 2013-10-29 US disclosed
CN-102395647-A White light-emitting monomolecular compound utilizing excited intramolecular proton transfer characteristics, and organic electroluminescent element and laser element each comprising same DONGWOO FINE CHEM CO LTD 2012-03-28 CN disclosed
US-20120046472-A1 WHITE-EMITTING COMPOUNDS USING EXCITED-STATE INTRAMOLECULAR PROTON TRANSFER, ORGANIC ELECTROLUMINESCENT ELEMENT AND LASER MATERIAL USING THE SAME SNU R&DB FOUNDATION (KR) 2012-02-23 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-20120046472-A1 WHITE-EMITTING COMPOUNDS USING EXCITED-STATE INTRAMOLECULAR PROTON TRANSFER, ORGANIC ELECTROLUMINESCENT ELEMENT AND LASER MATERIAL USING THE SAME ICMT, INCENP, TRMT1 BCHE 3596/4885ACHE 2537/4885GAA 2579/4885

“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.