SCHEMBL10136167

SCHEMBL10136167

CC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.36
PDK2 Q15119 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MCL1 Q07820 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA9 Q16790 3/20 0.30
CRHR1 P34998 1/20 0.30
SLC6A9 P48067 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL15495749 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15495729 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL20363801 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15496047 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15495990 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15138683 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15496125 1.00 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15495862 0.99 SIGMAR1 (0.36) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL15496061 0.99 SIGMAR1 (0.35) SIGMAR1PDK2L3MBTL1MCL1ACMSD
SCHEMBL13020812 0.99 SIGMAR1 (0.37) SIGMAR1PDK2L3MBTL1MCL1ACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180226601-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, DISPLAY DEVICE, AND MIXED MATERIAL IDEMITSU KOSAN CO., LTD. (JP) 2018-08-09 US disclosed
US-10026905-B2 Compound, organic electric element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-07-17 US disclosed
US-10026905-B2 Compound, organic electric element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-07-17 US disclosed
US-9966539-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2018-05-08 US disclosed
US-9966539-B2 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2018-05-08 US disclosed
US-20140374722-A1 COMPOUND, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2014-12-25 US disclosed
US-20140374722-A1 COMPOUND, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2014-12-25 US disclosed
US-8883324-B2 Aromatic amine derivative and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2014-11-11 US disclosed
US-8883324-B2 Aromatic amine derivative and organic electroluminescent device using same IDEMITSU KOSAN CO., LTD. (JP) 2014-11-11 US disclosed
US-20140084270-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-03-27 US disclosed
US-20140061602-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-03-06 US disclosed
WO-2013109027-A1 COMPOUND, ORGANIC ELECTRONIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREOF 덕산하이메탈(주) (KR) 2013-07-25 WO disclosed
US-20120302793-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. 2012-11-29 US disclosed
US-20120302793-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. 2012-11-29 US disclosed
US-20120228594-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-09-13 US disclosed
US-20120228594-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-09-13 US disclosed
US-20120184776-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-07-19 US disclosed
US-20120184776-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-07-19 US disclosed
US-20120112176-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-10 US disclosed
US-20120112176-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-05-10 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-20120184776-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME EML4, DDC, ALKBH2 SIGMAR1 2116/4885PDK2 1007/4885L3MBTL1 1286/4885
US-20120302793-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME NAT1, AFF1, AOC2 SIGMAR1 468/4885PDK2 1693/4885L3MBTL1 1935/4885
US-10026905-B2 Compound, organic electric element using the same, and an electronic device thereof ORAI2, TMEM109, EML4 SIGMAR1 3836/4885PDK2 2838/4885L3MBTL1 749/4885
US-20120112176-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME EML4, DDC, ALKBH2 SIGMAR1 2138/4885PDK2 1157/4885L3MBTL1 1137/4885
US-20180226601-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, DISPLAY DEVICE, AND MIXED MATERIAL TMEM109, L1CAM, CD99 SIGMAR1 1110/4885PDK2 1665/4885L3MBTL1 1896/4885

“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.