SCHEMBL31836

SCHEMBL31836

CC1(C)c2cc(Br)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.39
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.34
CRHBP P24387 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
CRHR2 Q13324 1/20 0.34
TLR9 Q9NR96 1/20 0.34
LRRK2 Q5S007 1/20 0.33
PTPRC P08575 1/20 0.32
PDE4B Q07343 1/20 0.31

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
SCHEMBL31692070 1.00 PDK2 (0.39) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL29474207 1.00 PDK2 (0.39) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL4228852 1.00 PDK2 (0.39) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL15087195 0.96 PDK2 (0.42) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL16682938 0.95 PDK2 (0.38) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL16773745 0.94 ALDH1A1 (0.38) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL15907005 0.94 ALDH1A1 (0.38) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL12872056 0.93 MAPK1 (0.39) PDK2ALDH1A1KDM4EMAPTPDE4B
SCHEMBL15906989 0.92 CYP2A6 (0.41) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL13024062 0.91 CYP2A6 (0.40) PDK2ALDH1A1L3MBTL1KDM4ECYP1A2

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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12507590-B2 Organic electric element comprising organic compound and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2025-12-23 US disclosed
US-12384796-B2 Electroactive compounds LG CHEM, LTD. (KR) 2025-08-12 US disclosed
US-12225819-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2025-02-11 US disclosed
US-20230111751-A1 ORGANIC ELECTRIC ELEMENT COMPRISING ORGANIC COMPOUND AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-04-13 US disclosed
US-20220376189-A1 ORGANIC ELECTRONIC DEVICE DUK SAN NEOLUX CO., LTD (KR) 2022-11-24 US disclosed
US-20220298130-A1 ORGANIC ELECTRONIC DEVICE DUK SAN NEOLUX CO., LTD (KR) 2022-09-22 US disclosed
US-9842996-B2 Amine compound having hetero-fused ring and organic electroluminescent element using amine compound IDEMITSU KOSAN CO., LTD. (JP) 2017-12-12 US disclosed
US-9842996-B2 Amine compound having hetero-fused ring and organic electroluminescent element using amine compound IDEMITSU KOSAN CO., LTD. (JP) 2017-12-12 US disclosed
WO-2017210072-A1 ELECTROACTIVE COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2017-12-07 WO disclosed
WO-2017210072-A1 ELECTROACTIVE COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2017-12-07 WO disclosed
US-20090179551-A1 Organic Electroluminescent Compounds and Display Device Using the Same GRACEL DISPLAY INC. (KP) 2009-07-16 US disclosed
US-20090179551-A1 Organic Electroluminescent Compounds and Display Device Using the Same GRACEL DISPLAY INC. (KP) 2009-07-16 US disclosed
EP-2075309-A2 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-07-01 EP disclosed
US-20090115320-A1 AROMATIC TRIAMINE COMPOUND AND ORGANIC ELECTTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-05-07 US disclosed
US-20090115320-A1 AROMATIC TRIAMINE COMPOUND AND ORGANIC ELECTTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-05-07 US disclosed
US-20090115320-A1 AROMATIC TRIAMINE COMPOUND AND ORGANIC ELECTTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2009-05-07 US disclosed
US-7425654-B2 Aromatic triamine compound and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2008-09-16 US disclosed
EP-1873138-A1 AROMATIC TRIAMINE COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-01-02 EP disclosed
WO-2007061218-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2007-05-31 WO disclosed
US-20060232198-A1 Aromatic triamine compound and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2006-10-19 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 (5 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-20220298130-A1 ORGANIC ELECTRONIC DEVICE EED, TERT, KCNN2 PDK2 2498/4885ALDH1A1 1413/4885L3MBTL1 222/4885
US-20060232198-A1 Aromatic triamine compound and organic electroluminescence device using the same TYR, PNMT, ALK PDK2 2863/4885ALDH1A1 1589/4885L3MBTL1 203/4885
US-20090115320-A1 AROMATIC TRIAMINE COMPOUND AND ORGANIC ELECTTROLUMINESCENCE DEVICE USING THE SAME EML4, ACVRL1, APOL1 PDK2 2864/4885ALDH1A1 1929/4885L3MBTL1 214/4885
US-12384796-B2 Electroactive compounds NES, NAT1, SCN1B PDK2 3765/4885ALDH1A1 1194/4885L3MBTL1 2543/4885
US-20090179551-A1 Organic Electroluminescent Compounds and Display Device Using the Same OCIAD2, OCIAD1, ICOSLG PDK2 1598/4885ALDH1A1 394/4885L3MBTL1 2568/4885

“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.