SCHEMBL6512153

SCHEMBL6512153

C[Si](C)(C)c1ccc(I)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
HDAC8 Q9BY41 2/20 0.38
APP P05067 2/20 0.34
TPMT P51580 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
METAP2 P50579 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
SCHEMBL586534 0.83 NR1H2 (0.50) NR1H2NR1H3
SCHEMBL9968169 0.81 ESR1 (0.44) NR1H2NR1H3HDAC8APPTPMT
SCHEMBL10032994 0.80 NR1H2 (0.42) NR1H2NR1H3APP
SCHEMBL21549228 0.75 SCN5A (0.35) NR1H2NR1H3
SCHEMBL10997473 0.73 NR1H2 (0.44) NR1H2NR1H3
SCHEMBL2703720 0.73 HDAC8 (0.42) HDAC8APPTPMTCA1CA2
SCHEMBL6434075 0.73 APP (0.32) HDAC8APP
SCHEMBL19257007 0.73 NR1H2 (0.50) NR1H2NR1H3HDAC8APP
SCHEMBL987122 0.71 ACHE (0.53) NR1H2NR1H3CA1CA2
SCHEMBL716493 0.71 PYCR1 (0.34) HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111499566-A Pyridine derivative compound and preparation method thereof 南京工业大学 2020-08-07 CN claimed
EP-4306612-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2024-01-17 EP disclosed
US-20230371357-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-16 US disclosed
US-11718606-B2 Polycyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2023-08-08 US disclosed
US-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US disclosed
EP-3564249-B1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEMICAL LTD (KR) 2021-01-20 EP disclosed
US-10862164-B2 Polymer electrolyte, method of preparing the polymer electrolyte, and lithium metal battery including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-12-08 US disclosed
CN-111499566-A Pyridine derivative compound and preparation method thereof 南京工业大学 2020-08-07 CN disclosed
US-10604469-B2 Method for the preparation of a partially hydrogenated polyacene and an intermediate thereof FUNDACIO INSTITUT CATALA D'INVESTIGACIO QUIMICA (ES) 2020-03-31 US disclosed
US-20200048232-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-13 US disclosed
US-20160020400-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2016-01-21 US disclosed
US-20120177578-A1 COMPOSITIONS, METHODS, AND SYSTEMS COMPRISING FLUOROUS-SOLUBLE POLYMERS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-07-12 US disclosed
WO-2010007756-A1 PYRIDINE DERIVATIVE HAVING TTK INHIBITION ACTIVITY 塩野義製薬株式会社 (JP) 2010-01-21 WO disclosed
US-20090256468-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-10-15 US disclosed
EP-2096108-A1 Novel organic electroluminescent compounds and organic electroluminscent device using the same Gracel Display Inc. (KR) 2009-09-02 EP disclosed
US-20090200926-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-08-13 US disclosed
EP-2067767-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2009-06-10 EP disclosed
US-20050101063-A1 Three-terminal field-controlled molecular devices TOUR JAMES M (US) 2005-05-12 US disclosed
WO-2002035580-A2 THREE-TERMINAL FIELD-CONTROLLED MOLECULAR DEVICES MOLECULAR ELECTRONICS CORPORATION (US) 2002-05-02 WO disclosed
US-6123917-A Method for making cocaine receptor binding ligands and intermediates therefor RESEARCH TRIANGLE INSTITUTE (US) 2000-09-26 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 (8 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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 NR1H2 504/4885NR1H3 369/4885HDAC8 1237/4885
US-20200048232-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 NR1H2 103/4885NR1H3 80/4885HDAC8 4376/4885
US-11718606-B2 Polycyclic compound and organic light emitting element comprising same CRY1, CRY2, CYP1A1 NR1H2 103/4885NR1H3 80/4885HDAC8 4376/4885
US-10604469-B2 Method for the preparation of a partially hydrogenated polyacene and an intermediate thereof PARN, PCBP1, PARG NR1H2 2883/4885NR1H3 2599/4885HDAC8 1415/4885
US-20230371357-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE L1CAM, CHRM1, FOXM1 NR1H2 1579/4885NR1H3 1819/4885HDAC8 4643/4885
US-20090256468-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD1, OCIAD2 NR1H2 272/4885NR1H3 339/4885HDAC8 4579/4885
US-20090200926-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same NQO1, NDUFS2, NDUFS5 NR1H2 1830/4885NR1H3 1889/4885HDAC8 4645/4885
US-20120177578-A1 COMPOSITIONS, METHODS, AND SYSTEMS COMPRISING FLUOROUS-SOLUBLE POLYMERS NAF1, PFAS, MALT1 NR1H2 690/4885NR1H3 403/4885HDAC8 4692/4885

“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.