SCHEMBL614860

SCHEMBL614860

Brc1ccc2c(c1)c1cc(Br)ccc1n2-c1cccc(-c2nn[nH]n2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GP6 Q9HCN6 1/20 0.48
ATM Q13315 1/20 0.48
IDO1 P14902 1/20 0.47
ALDH1A1 P00352 1/20 0.46
PFKFB4 Q16877 1/20 0.44
PFKFB3 Q16875 1/20 0.42
TDP2 O95551 1/20 0.42
GPR35 Q9HC97 2/20 0.42
PTK2 Q05397 1/20 0.40
MAPT P10636 1/20 0.40
XDH P47989 1/20 0.39
USP2 O75604 1/20 0.38
CYP2A6 P11509 1/20 0.38
ADH5 P11766 1/20 0.38
PTGFR P43088 1/20 0.38
CSNK2A1 P68400 1/20 0.38
MLYCD O95822 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL613321 0.85 GP6 (0.62) GP6IDO1ALDH1A1PFKFB4PFKFB3
SCHEMBL2993165 0.77 GP6 (0.49) GP6IDO1ALDH1A1PFKFB4PFKFB3
SCHEMBL4258013 0.77 GP6 (0.66) GP6ATMIDO1ALDH1A1PFKFB4
SCHEMBL12362763 0.76 ATM (0.41) ATMALDH1A1MAPTUSP2CSNK2A1
SCHEMBL30955443 0.76 ATM (0.41) ATMALDH1A1MAPTUSP2CSNK2A1
SCHEMBL29616154 0.76 ATM (0.41) ATMALDH1A1MAPTUSP2CSNK2A1
SCHEMBL12455351 0.75 ABCG2 (0.44) ATMALDH1A1MAPTCSNK2A1NPC1
SCHEMBL30928305 0.75 ABCG2 (0.44) ATMALDH1A1MAPTCSNK2A1NPC1
SCHEMBL926625 0.75 GP6 (0.55) GP6IDO1ALDH1A1PFKFB3TDP2
SCHEMBL12156924 0.75 MAPT (0.41) ATMALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859113-B2 Carbazole derivatives and organic light-emitting diode device using the same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-10-14 US disclosed
US-8859113-B2 Carbazole derivatives and organic light-emitting diode device using the same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-10-14 US disclosed
US-8859113-B2 Carbazole derivatives and organic light-emitting diode device using the same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-10-14 US disclosed
US-20140175400-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-06-26 US disclosed
US-20140175400-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-06-26 US disclosed
US-20140175400-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2014-06-26 US disclosed
US-8580396-B2 Carbazole derivatives and organic light-emitting diode device using the same China Petrochemical Development Corp (TW) 2013-11-12 US disclosed
US-8580396-B2 Carbazole derivatives and organic light-emitting diode device using the same China Petrochemical Development Corp (TW) 2013-11-12 US disclosed
US-8580396-B2 Carbazole derivatives and organic light-emitting diode device using the same China Petrochemical Development Corp (TW) 2013-11-12 US disclosed
US-20120038264-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2012-02-16 US disclosed
US-20120038264-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2012-02-16 US disclosed
US-20120038264-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same CHINA PETROCHEMICAL DEVELOPMENT CORPORATION (TW) 2012-02-16 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-20120038264-A1 Novel Carbazole Derivatives and Organic Light-Emitting Diode Device Using the Same DRD1, DRD3, CYBA GP6 3731/4885ATM 3930/4885IDO1 251/4885

“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.