SCHEMBL1002830

SCHEMBL1002830

CC(=Nc1c(C(C)C)cccc1C(C)C)c1cccc(C(C)=Nc2c(C(C)C)cccc2C(C)C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
LMNA P02545 3/20 0.41
GABRB2 P47870 2/20 0.41
TSHR P16473 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 1/20 0.41

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
SCHEMBL808792 1.00 GABRA1 (0.41) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL27608902 0.98 GABRA1 (0.40) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL5589413 0.98 GABRA1 (0.40) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL7171618 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL6915966 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL1685885 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL1575632 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL7176112 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL6909108 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2
Hydrochloric Acid SCHEMBL1575753 0.97 GABRA1 (0.39) GABRA1GABRG2GABRB3LMNAGABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP claimed
EP-3184172-B1 HYDROSILYLATION IRON CATALYST UNIV KYUSHU NAT UNIV CORP (JP) 2024-09-04 EP disclosed
WO-2023112847-A1 ORGANOSILOXANE-BASED HYDROGEN STORAGE COMPOSITION 国立大学法人東京大学 2023-06-22 WO disclosed
WO-2022154114-A1 TRANSITION METAL COMPLEX/SILICON COMPOSITES AND CATALYST 国立大学法人東京大学 2022-07-21 WO disclosed
CN-106573235-B Iron hydrosilylate catalyst 国立大学法人九州大学 2020-07-07 CN disclosed
EP-2451820-B1 HYDROSILYLATION CATALYSTS MOMENTIVE PERFORMANCE MAT INC (US) 2020-03-18 EP disclosed
US-10239896-B2 Hydrosilylation iron catalyst KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2019-03-26 US disclosed
US-20170260216-A1 HYDROSILYLATION IRON CATALYST KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-09-14 US disclosed
EP-3184172-A1 HYDROSILYLATION IRON CATALYST Kyushu University, National University Corporation (JP) 2017-06-28 EP disclosed
EP-2643329-B1 IN-SITU ACTIVATION OF METAL COMPLEXES USED AS HYDROSILYLATION CATALYSTS MOMENTIVE PERFORMANCE MAT INC (US) 2016-07-27 EP disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
WO-2005103100-A1 POLYETHYLENE AND CATALYST COMPOSITION FOR ITS PREPARATION BASELL POLYOLEFINE GMBH (DE) 2005-11-03 WO disclosed
WO-2005103096-A1 POLYETHYLENE FOR INJECTION MOLDINGS BASELL POLYOLEFINE GMBH (DE) 2005-11-03 WO disclosed
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed
US-20040127382-A1 Use of transition metal complexes with nitrogen-containing polydentate ligands as a bleaching catalyst and bleaching agent composition DEGUSSA AG (DE) 2004-07-01 US disclosed
US-20040044149-A1 Cr complexes and their use for the polymerization of alpha-olefins SOLVAY POLYOLEFINS EUROPE-BELGIUM (BE) 2004-03-04 US disclosed
EP-1201683-A1 Process for the polymerisation of alpha-olefins SOLVAY POLYOLEFINS EUROPE - BELGIUM (Société Anonyme) (BE) 2002-05-02 EP disclosed
EP-1188762-A1 Chromium complexes and their use for the polymerization of alpha-olefins Solvay Polyolefins Europe-Belgium (Société Anonyme) (BE) 2002-03-20 EP disclosed
EP-1059313-A1 Transition metal catalyst component for polymerization, aromatic vinyl compound-olefin copolymer and process for its production by means of the catalyst component DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2000-12-13 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 (3 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-10239896-B2 Hydrosilylation iron catalyst SLC40A1, FTH1, SFXN1 GABRA1 3933/4885GABRG2 4240/4885GABRB3 4561/4885
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 GABRA1 3688/4885GABRG2 3901/4885GABRB3 3425/4885
US-20170260216-A1 HYDROSILYLATION IRON CATALYST SLC40A1, FTH1, SFXN1 GABRA1 3933/4885GABRG2 4240/4885GABRB3 4561/4885

“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.