SCHEMBL31896

SCHEMBL31896

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5oc6ccccc6c5ccc43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.40
MAPT P10636 10/20 0.38
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 4/20 0.37
POLB P06746 2/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 4/20 0.37
HSD17B10 Q99714 4/20 0.37
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
USP2 O75604 1/20 0.36
HTT P42858 1/20 0.36
CYP1A2 P05177 3/20 0.35
CYP3A4 P08684 3/20 0.35
CYP2C19 P33261 3/20 0.35
CYP2C9 P11712 2/20 0.35
CSF1R P07333 1/20 0.35
PDGFRB P09619 1/20 0.35

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
SCHEMBL15625585 0.98 TSHR (0.38) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL16160432 0.98 TSHR (0.38) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL21365552 0.98 TSHR (0.38) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL26841921 0.97 TSHR (0.40) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL16437627 0.96 ALDH1A1 (0.38) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL17990639 0.94 TSHR (0.38) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL18926323 0.94 TSHR (0.39) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL16437637 0.94 TSHR (0.42) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL21965605 0.93 TSHR (0.36) TSHRMAPTALDH1A1KDM4EPOLB
SCHEMBL21365553 0.93 TSHR (0.36) TSHRMAPTALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12048239-B2 Composition for organic optoelectronic device, organic optoelectronic device and display device SAMSUNG SDI CO., LTD. (KR) 2024-07-23 US disclosed
US-12048239-B2 Composition for organic optoelectronic device, organic optoelectronic device and display device SAMSUNG SDI CO., LTD. (KR) 2024-07-23 US disclosed
WO-2024080856-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-04-18 WO disclosed
US-20230389419-A1 MATERIAL FOR PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-11-30 US disclosed
US-20230389419-A1 MATERIAL FOR PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-11-30 US disclosed
EP-3767698-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-25 EP disclosed
US-20230276690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2023-08-31 US disclosed
US-20230263054-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2023-08-17 US disclosed
US-20230263054-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2023-08-17 US disclosed
US-11696499-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-04 US disclosed
US-20140084270-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-03-27 US disclosed
US-20140084270-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-03-27 US disclosed
US-20140054564-A1 ELECTROLUMINESCENT DEVICE USING ELECTROLUMINESCENT COMPOUND AS LUMINESCENT MATERIAL ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-02-27 US disclosed
US-20140054564-A1 ELECTROLUMINESCENT DEVICE USING ELECTROLUMINESCENT COMPOUND AS LUMINESCENT MATERIAL ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2014-02-27 US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
WO-2012026780-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-01 WO disclosed
WO-2010136109-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-02 WO disclosed
WO-2010136109-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-02 WO 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 (4 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-20230389419-A1 MATERIAL FOR PHOTOELECTRIC CONVERSION ELEMENT FOR IMAGING NR2E3, ARPC3, NAP1L4 TSHR 4166/4885MAPT 2757/4885ALDH1A1 2670/4885
US-20230276690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME L1CAM, TELO2, LIMS1 TSHR 4584/4885MAPT 2197/4885ALDH1A1 149/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 TSHR 4710/4885MAPT 1399/4885ALDH1A1 1226/4885
US-12048239-B2 Composition for organic optoelectronic device, organic optoelectronic device and display device OR10J3, OCIAD2, OCIAD1 TSHR 3995/4885MAPT 2175/4885ALDH1A1 360/4885

“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.