SCHEMBL4580501

SCHEMBL4580501

c1ccc(N(c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)c2cccc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.50
ALDH1A1 P00352 4/20 0.41
CYP1A2 P05177 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
CYP3A4 P08684 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
CYP2A6 P11509 3/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
HPGD P15428 1/20 0.38
KEAP1 Q14145 1/20 0.38
NR4A1 P22736 1/20 0.38
NR4A2 P43354 1/20 0.38
NR4A3 Q92570 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
SCHEMBL4893902 1.00 SIGMAR1 (0.50) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13020767 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13020766 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13720623 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13020775 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL4581137 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13720498 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL13721259 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL12119474 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4
SCHEMBL29371519 0.98 SIGMAR1 (0.49) SIGMAR1ALDH1A1CYP1A2TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200044166-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-02-06 US disclosed
US-9257663-B2 Organic electroluminescent element and display device SONY CORPORATION (JP) 2016-02-09 US disclosed
US-20150333279-A1 ORGANIC LIGHT-EMITTING ELEMENT AND DISPLAY APPARATUS SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-11-19 US disclosed
US-20150333279-A1 ORGANIC LIGHT-EMITTING ELEMENT AND DISPLAY APPARATUS SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-11-19 US disclosed
US-9105858-B2 Organic electroluminescent device and display apparatus JOLED INC. (JP) 2015-08-11 US disclosed
US-9105858-B2 Organic electroluminescent device and display apparatus JOLED INC. (JP) 2015-08-11 US disclosed
US-20150171356-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND DISPLAY DEVICE MAGNOLIA BLUE CORPORATION (JP) 2015-06-18 US disclosed
US-20150171356-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND DISPLAY DEVICE MAGNOLIA BLUE CORPORATION (JP) 2015-06-18 US disclosed
US-20150060837-A1 ORGANIC ELECTROLUMINESCENCE DEVICE SONY CORPORATION (JP) 2015-03-05 US disclosed
US-20150060837-A1 ORGANIC ELECTROLUMINESCENCE DEVICE SONY CORPORATION (JP) 2015-03-05 US disclosed
US-7396599-B2 Binuclear organometallic complexes and organic electroluminescent display device using the same SAMSUNG SDI CO., LTD. (KR) 2008-07-08 US disclosed
EP-0390196-B1 Electrophotosensitive material MITA INDUSTRIAL CO LTD (JP) 1995-09-20 EP disclosed
EP-0385440-B1 Electrophotosensitive material MITA INDUSTRIAL CO LTD (JP) 1995-05-03 EP disclosed
EP-0314195-B1 Electrophotographic sensitive material MITA INDUSTRIAL CO LTD (JP) 1995-03-22 EP disclosed
US-5153088-A High sensitivity mixture also with charge transferring substituted phenyl diamines MITA INDUSTRIAL CO., LTD. (JP) 1992-10-06 US disclosed
US-5059503-A Used for copying machine MITA INDUSTRIAL CO., LTD. (JP) 1991-10-22 US disclosed
EP-0390196-A2 Electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1990-10-03 EP disclosed
EP-0385440-A2 Electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1990-09-05 EP disclosed
US-4877702-A PERYLENE TYPE ELECTRIC CHARGE GENERATING SUBSTANCE AND DIAMINE DERIVATIVE AS ELECTRIC CHARGE TRANSFERRING SUBSTANCE MITA INDUSTRIAL CO., LTD. (JP) 1989-10-31 US disclosed
EP-0314195-A2 Electrophotographic sensitive material MITA INDUSTRIAL CO. LTD. (JP) 1989-05-03 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-20200044166-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND OR10J3, ORC3, L1CAM SIGMAR1 2315/4885ALDH1A1 14/4885CYP1A2 320/4885

“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.