Sugi Predict

Sugi Predict / Compounds / SCHEMBL646563

SCHEMBL646563

SCHEMBL646563

CC(C)(C)c1ccnc(-c2cccc(-c3ccccc3)c2)c1.CC(C)(C)c1ccnc(-c2cccc(-c3ccccc3)c2)c1.CC(C)(C)c1ccnc(-c2cccc(-c3ccccc3)c2)c1.[Ir]

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.51
▸ RXRA P19793 2/20 0.43
▸ RXRB P28702 2/20 0.43
▸ SYK P43405 2/20 0.43
▸ ASIC3 Q9UHC3 2/20 0.42
▸ KMO O15229 2/20 0.42
▸ DHODH Q02127 1/20 0.40
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ METAP2 P50579 1/20 0.37
▸ MAPKAPK2 P49137 2/20 0.36
▸ CTSA P10619 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL29663840 1.00 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL28790717 1.00 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL2481424 0.98 KIF11 (0.53) KIF11RXRARXRBSYKASIC3
SCHEMBL15263772 0.97 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL30416106 0.97 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL15991694 0.97 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL15279893 0.97 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL30182884 0.97 KIF11 (0.51) KIF11RXRARXRBSYKASIC3
SCHEMBL26471845 0.92 KIF11 (0.50) KIF11RXRARXRBASIC3KMO
SCHEMBL18695526 0.90 ASIC3 (0.52) KIF11ASIC3METAP2MAPKAPK2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240244957-A1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL Merck Patent KGaA (DE) 2024-07-18 — — US disclosed
CN-117730638-A Printing method by combining inks 默克专利有限公司 2024-03-19 — — CN disclosed
CN-117178031-A Preparation of organic functional material 默克专利有限公司 2023-12-05 — — CN disclosed
EP-3475372-B1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-11-22 — — EP disclosed
EP-3387077-B1 FORMULATIONS CONTAINING KETONES COMPRISING NON-AROMATIC CYCLES MERCK PATENT GMBH (DE) 2023-10-18 — — EP disclosed
US-11770971-B2 Esters containing aromatic groups as solvents for organic electronic formulations MERCK PATENT GMBH (DE) 2023-09-26 — — US disclosed
CN-116635491-A Ink system and method for inkjet printing 默克专利有限公司 2023-08-22 — — CN disclosed
CN-110168047-B Preparation of organic functional material 默克专利有限公司 2023-08-08 — — CN disclosed
CN-110892543-B Preparation of organic functional material 默克专利有限公司 2023-07-28 — — CN disclosed
EP-3807367-B1 FORMULATION OF AN ORGANIC FUNCTIONAL MATERIAL MERCK PATENT GMBH (DE) 2023-07-19 — — EP disclosed
US-20120245658-A1 Therapeutic and Cosmetic Electroluminescent Compositions MERCK PATENT GMBH (DE) 2012-09-27 — — US disclosed
US-20120238105-A1 FORMULATIONS FOR THE PRODUCTION OF ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-09-20 — — US disclosed
US-20120132898-A1 ELECTRONIC DEVICES COMPRISING MULTI CYCLIC HYDROCARBONS MERCK PATENT GMBH (DE) 2012-05-31 — — US disclosed
US-20120107989-A1 CROSS-LINKABLE IRIDIUM COMPLEXES AND ORGANIC LIGHT-EMITTING DEVICES USING THE SAME UNIVERSAL DISPLAY CORPORATION 2012-05-03 — — US disclosed
US-8119255-B2 First and second electrode; a first organic layer between the electrodes; the first organic layer is a non-electroluminescent, cross-linked metal complex; and a second organic layer is an emissive electroluminescent organic material UNIVERSAL DISPLAY CORPORATION (US) 2012-02-21 — — US disclosed
US-20110105778-A1 Materials for Organic Electroluminescence Devices MERCK PATENT GMBH (DE) 2011-05-05 — — US disclosed
US-7825587-B2 Charge transporting layer for organic electroluminescent device UNIVERSAL DISPLAY CORPORATION (US) 2010-11-02 — — US disclosed
US-20080220265-A1 Cross-linkable Iridium Complexes and Organic Light-Emitting Devices Using the Same UNIVERSAL DISPLAY CORPORATION (US) 2008-09-11 — — US disclosed
WO-2008073440-A2 CROSS-LINKABLE IRIDIUM COMPLEXES AND ORGANIC LIGHT-EMITTING DEVICES USING THE SAME UNIVERSAL DISPLAY CORPORATION (US) 2008-06-19 — — WO disclosed
US-20080054783-A1 Cross-linked host materials in organic devices UNIVERSAL DISPLAY CORP. (US) 2008-03-06 — — 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-20120238105-A1 FORMULATIONS FOR THE PRODUCTION OF ELECTRONIC DEVICES NR3C2, KCNE1, KCNJ2 KIF11 1249/4885RXRA 2810/4885RXRB 2278/4885
US-20080220265-A1 Cross-linkable Iridium Complexes and Organic Light-Emitting Devices Using the Same MTCL3, LIG4, L1CAM KIF11 2377/4885RXRA 1430/4885RXRB 2062/4885
US-20110105778-A1 Materials for Organic Electroluminescence Devices L1CAM, EPCAM, GPX1 KIF11 2945/4885RXRA 4143/4885RXRB 4207/4885
US-20120107989-A1 CROSS-LINKABLE IRIDIUM COMPLEXES AND ORGANIC LIGHT-EMITTING DEVICES USING THE SAME MTCL3, LIG4, L1CAM KIF11 2377/4885RXRA 1430/4885RXRB 2062/4885
US-20120245658-A1 Therapeutic and Cosmetic Electroluminescent Compositions LPO, TYR, GPX1 KIF11 3829/4885RXRA 220/4885RXRB 410/4885

“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.