SCHEMBL6850488

SCHEMBL6850488

CCN(CC)c1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.57
MEN1 O00255 9/20 0.57
KMT2A Q03164 9/20 0.57
MAPK1 P28482 8/20 0.57
L3MBTL1 Q9Y468 7/20 0.57
MAPT P10636 6/20 0.57
HPGD P15428 5/20 0.57
HSD17B10 Q99714 1/20 0.57
CYP1A2 P05177 3/20 0.56
RAB9A P51151 7/20 0.55
NPC1 O15118 6/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
LMNA P02545 2/20 0.55
GAA P10253 2/20 0.51
TDP1 Q9NUW8 3/20 0.51
THRB P10828 3/20 0.51
ATM Q13315 2/20 0.51
KDM4E B2RXH2 1/20 0.51
HTT P42858 1/20 0.51
MCL1 Q07820 1/20 0.51

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
SCHEMBL6444104 0.98 MAPK1 (0.59) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL14982137 0.94 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL29518420 0.90 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL4627668 0.90 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL9514208 0.90 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL18984698 0.86 MAPK1 (0.54) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL9642071 0.84 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL20313056 0.84 MAPK1 (0.56) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL2018342 0.84 RAB9A (0.53) ALDH1A1MEN1KMT2AMAPK1L3MBTL1
SCHEMBL18984697 0.83 MAPK1 (0.51) ALDH1A1MEN1KMT2AMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10263308-B2 Solar flow battery CORNELL UNIVERSITY (US) 2019-04-16 US disclosed
US-10079401-B2 Symmetric redox flow battery containing organic redox active molecule CORNELL UNIVERSITY (US) 2018-09-18 US disclosed
US-20170187059-A1 SYMMETRIC REDOX FLOW BATTERY CONTAINING ORGANIC REDOX ACTIVE MOLECULE CORNELL UNIVERSITY (US) 2017-06-29 US disclosed
US-20170179558-A1 SOLAR FLOW BATTERY CORNELL UNIVERSITY (US) 2017-06-22 US disclosed
US-6703084-B2 CONTRAST; FOR USE IN SPATIAL LIGHT MODULATOR, AND LIQUID CRYSTAL DISPLAY OF OPTICALLY-ADDRESSED OR THERMALLY-ADDRESSED TYPE FUJI PHOTO FILM CO., LTD. (JP) 2004-03-09 US disclosed
US-20030085379-A1 Quinone compound, liquid crystal composition, and guest-host-type liquid crystal cell employing the same FUJIFILM CORPORATION (JP) 2003-05-08 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-20030085379-A1 Quinone compound, liquid crystal composition, and guest-host-type liquid crystal cell employing the same NR5A1, RCC1, NAP1L1 ALDH1A1 399/4885MEN1 2099/4885KMT2A 2402/4885

“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.