SCHEMBL3907873

SCHEMBL3907873

O=C1c2ccccc2-c2cccc(-c3ccccn3)c21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 3/20 0.48
LMNA P02545 5/20 0.48
KDM4E B2RXH2 5/20 0.48
CCR1 P32246 2/20 0.48
CCR5 P51681 2/20 0.48
CCR8 P51685 2/20 0.48
POLB P06746 2/20 0.48
BLM P54132 2/20 0.48
CYP1A2 P05177 1/20 0.48
METAP1 P53582 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
IDO1 P14902 2/20 0.47
HTT P42858 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 3/20 0.47
MAPK1 P28482 2/20 0.47
ALOX15 P16050 2/20 0.47
TDP1 Q9NUW8 2/20 0.47

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
SCHEMBL4411800 0.92 ADORA2A (0.50) PTPRCLMNAKDM4ECCR1CCR5
SCHEMBL29157744 0.84 KDM4E (0.56) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL29177908 0.82 KDM4E (0.54) LMNAKDM4ECCR1CCR5CCR8
Anthraquinone SCHEMBL28208174 0.81 KDM4E (0.67) PTPRCLMNAKDM4ECCR1CCR5
SCHEMBL27924279 0.81 KDM4E (0.65) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL12853975 0.79 KDM4E (0.68) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL22881677 0.79 KDM4E (0.68) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL29723140 0.79 KDM4E (0.68) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL12853986 0.79 KDM4E (0.68) LMNAKDM4ECCR1CCR5CCR8
SCHEMBL2482338 0.78 KDM4E (0.54) LMNAKDM4ECCR1CCR5CCR8

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-7501216-B2 Azine-based charge transport materials SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-03-10 US disclosed
EP-1482377-B1 Azine-based charge transport materials SAMSUNG ELECTRONICS CO LTD (KR) 2008-03-26 EP disclosed
US-20040241562-A1 Azine-based charge transport materials HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2004-12-02 US disclosed
EP-1482377-A1 Azine-based charge transport materials Samsung Electronics Co., Ltd. (KR) 2004-12-01 EP 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-20040241562-A1 Azine-based charge transport materials CDY1; CDY1B, ZYX, CDYL PTPRC 1836/4885LMNA 3027/4885KDM4E 1714/4885

“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.