SCHEMBL472209

SCHEMBL472209

Sc1nc2cc3ccccc3cc2nc1S

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 4/20 0.62
ALDH1A1 P00352 4/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 2/20 0.43
GLA P06280 1/20 0.43
ACHE P22303 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RPS6KB2 Q9UBS0 1/20 0.43
PDPK1 O15530 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
PI4KA P42356 1/20 0.39
PI4K2B Q8TCG2 1/20 0.39
PI4K2A Q9BTU6 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
MEN1 O00255 2/20 0.39
NPC1 O15118 2/20 0.39
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 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
SCHEMBL13156487 0.82 NQO2 (0.88) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL594018 0.79 MAPT (0.62) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL11540981 0.78 NQO1 (0.44) NQO2
SCHEMBL2247546 0.77 NQO2 (0.68) NQO2ALDH1A1MAPTHPGDGLA
Benzo[B]Phenazine SCHEMBL5481172 0.77 NQO2 (1.00) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL31319857 0.74 NQO2 (0.94) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL18397673 0.72 NQO2 (0.62) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL472172 0.72 TDP1 (0.65) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL7695642 0.72 ALDH1A1 (0.65) NQO2ALDH1A1MAPTHPGDGLA
SCHEMBL30969485 0.72 TDP1 (0.65) NQO2ALDH1A1MAPTHPGDGLA

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-8530673-B2 Tetrathiafulvalene derivative, and organic film and organic transistor using the same RICOH COMPANY, LTD. (JP) 2013-09-10 US disclosed
EP-2411378-B1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH CO LTD (JP) 2012-12-19 EP disclosed
EP-2411378-B1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH CO LTD (JP) 2012-12-19 EP disclosed
US-20120035364-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH COMPANY, LTD. (JP) 2012-02-09 US disclosed
US-20120035364-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH COMPANY, LTD. (JP) 2012-02-09 US disclosed
US-20120035364-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH COMPANY, LTD. (JP) 2012-02-09 US disclosed
EP-2411378-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME Ricoh Company, Ltd. (JP) 2012-02-01 EP disclosed
WO-2010110351-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME RICOH COMPANY, LTD. (JP) 2010-09-30 WO 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-20120035364-A1 TETRATHIAFULVALENE DERIVATIVE, AND ORGANIC FILM AND ORGANIC TRANSISTOR USING THE SAME TCOF1, F12, F5 NQO2 3118/4885ALDH1A1 2811/4885MAPT 1984/4885

“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.