SCHEMBL5571565

SCHEMBL5571565

Cc1cccc(N(c2ccc(N(c3ccc(N(c4cccc(C)c4)c4ccc5ccccc5c4)cc3)c3ccc(N(c4cccc(C)c4)c4ccc5ccccc5c4)cc3)cc2)c2ccc3ccccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 5/20 0.52
▸ TDP1 Q9NUW8 3/20 0.52
▸ CYP1A2 P05177 6/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ NR1I2 O75469 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ HTR2B P41595 1/20 0.50
▸ CYP51A1 Q16850 1/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ACHE P22303 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
SCHEMBL13136843 1.00 CYP2A6 (0.52) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL16627120 0.98 CYP2A6 (0.50) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL14505881 0.98 CYP2A6 (0.54) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL30670629 0.98 CYP2A6 (0.54) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL29438468 0.95 CYP2A6 (0.47) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL2246996 0.95 CYP2A6 (0.47) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL29438465 0.95 CYP2A6 (0.47) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL16344226 0.95 CYP2A6 (0.47) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL14673069 0.95 CYP2A6 (0.47) CYP2A6TDP1CYP1A2CYP3A4MAPT
SCHEMBL12722008 0.94 TDP1 (0.44) CYP2A6TDP1CYP1A2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1701592-B1 A method of making an electroluminescent device 3M INNOVATIVE PROPERTIES CO (US) 2007-12-12 — — EP disclosed
EP-1722601-B1 An electroluminescent device and a method of making the same 3M INNOVATIVE PROPERTIES CO (US) 2007-10-24 — — EP disclosed
EP-1703778-B1 A method of making an electroluminescent device 3M INNOVATIVE PROPERTIES CO (US) 2007-09-12 — — EP disclosed
EP-1676467-B1 ELECTROLUMINESCENT DEVICES AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2007-05-02 — — EP disclosed
EP-1722601-A1 An electroluminescent device and a method of making the same 3M Innovative Properties Company (US) 2006-11-15 — — EP disclosed
EP-1703778-A1 A method of making an electroluminescent device 3M Innovative Properties Company (US) 2006-09-20 — — EP disclosed
EP-1701592-A1 A method of making an electroluminescent device 3M Innovative Properties Company (US) 2006-09-13 — — EP disclosed
US-20040049080-A1 Novel triphenylamines and use thereof SHIROTA, YASUHIKO (JP) 2004-03-11 — — US disclosed
EP-1300390-A1 NOVEL TRIPHENYLAMINES AND USE THEREOF BANDO CHEMICAL INDUSTRIES, LTD. (JP) 2003-04-09 — — 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-20040049080-A1 Novel triphenylamines and use thereof NAT1, TPR, PNMT CYP2A6 2949/4885TDP1 90/4885CYP1A2 388/4885

“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.

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