SCHEMBL5553099

SCHEMBL5553099

CC1=Cc2cccc(-c3ccc(C(C)(C)C)cc3)c2C1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 3/20 0.39
TSHR P16473 1/20 0.38
BRD4 O60885 2/20 0.36
CREBBP Q92793 1/20 0.36
PARP1 P09874 1/20 0.34
KIF11 P52732 3/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
S1PR1 P21453 1/20 0.33
DGAT1 O75907 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
HTR1D P28221 1/20 0.31
ADRA1A P35348 1/20 0.31
NISCH Q9Y2I1 1/20 0.31

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
SCHEMBL30065602 1.00 PTAFR (0.39) PTAFRTSHRBRD4CREBBPPARP1
SCHEMBL14142022 0.86 PTAFR (0.36) PTAFRKIF11
SCHEMBL27500689 0.85 KDR (0.38) PTAFRNPC1LMNATP53RAB9A
SCHEMBL16406306 0.83 PTAFR (0.39) PTAFRTSHRBRD4CREBBPPARP1
SCHEMBL3154256 0.82 PDCD1 (0.38) ALDH1A1
SCHEMBL15808761 0.81 PTAFR (0.34) PTAFRTSHRBRD4KIF11NPC1
SCHEMBL4558348 0.81 PTAFR (0.37) PTAFRTSHRBRD4CREBBPPARP1
SCHEMBL6231893 0.81 PTAFR (0.37) PTAFRTSHRBRD4CREBBPPARP1
SCHEMBL15808729 0.80 PTAFR (0.39) PTAFRTSHRBRD4KIF11NPC1
SCHEMBL27744867 0.78 CD274 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4700052-A1 HYBRID SUPPORTED METALLOCENE CATALYST AND METHOD FOR PREPARING POLYETHYLENE USING SAME LG Chem, Ltd. (KR) 2026-02-25 EP disclosed
US-12195563-B2 Polyolefin-based ionomers and production thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2025-01-14 US disclosed
CN-112745366-B Silicon-based bridged metallocene compound, and preparation method and application thereof 中国石油化工股份有限公司 2024-05-24 CN disclosed
US-20240084056-A1 Polyolefin-Based Ionomers and Production Thereof EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-03-14 US disclosed
EP-4271718-A1 POLYOLEFIN-BASED IONOMERS AND PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-11-08 EP disclosed
CN-116670188-A Polyolefin-based ionomers and preparation thereof 埃克森美孚化学专利公司 2023-08-29 CN disclosed
US-20220213241-A1 Polyolefin-Based Ionomers and Production Thereof EXXONMOBIL CHEMICAL PATENTS INC (US) 2022-07-07 US disclosed
WO-2022146634-A1 POLYOLEFIN-BASED IONOMERS AND PRODUCTION THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-07-07 WO disclosed
EP-2915824-B1 METALLOCENE LIGANDS, METALLOCENE COMPOUNDS AND METALLOCENE CATALYSTS, THEIR SYNTHESIS AND THEIR USE FOR THE POLYMERIZATION OF OLEFINS LUMMUS NOVOLEN TECHNOLOGY GMBH (DE) 2022-05-25 EP disclosed
CN-112745366-A Silicon-based bridged metallocene compound and preparation method and application thereof 中国石油化工股份有限公司 2021-05-04 CN disclosed
US-7199274-B2 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2007-04-03 US disclosed
EP-1740622-A2 METALLOCENE LIGANDS, METALLOCENE COMPOUNDS AND METALLOCENE CATALYSTS, THEIR SYNTHESIS AND THEIR USE FOR THE POLYMERIZATION OF OLEFINS Novolen Technology Holdings C.V. (NL) 2007-01-10 EP disclosed
US-20050256344-A1 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2005-11-17 US disclosed
WO-2005105863-A2 METALLOCENE LIGANDS, METALLOCENE COMPOUNDS AND METALLOCENE CATALYSTS, THEIR SYNTHESIS AND THEIR USE FOR THE POLYMERIZATION OF OLEFINS NOVOLEN TECHNOLOGY HOLDINGS C.V. (NL) 2005-11-10 WO disclosed
US-20050239979-A1 Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins LUMMUS NOVOLEN TECHNOLOGY GMBH (DE) 2005-10-27 US disclosed
EP-1313747-B1 METHOD FOR PRODUCING ALKYL-BRIDGED LIGAND SYSTEMS AND TRANSITION METAL COMPOUNDS BASELL POLYOLEFINE GMBH (DE) 2005-04-20 EP disclosed
US-6784305-B2 DERIVATIVES OF ZIRCONOCENE DICHLORIDE IN WHICH THE TWO SUBSTITUTED INDENYL GROUPS ARE JOINED TO ONE ANOTHER VIA A BRIDGE CAN, OWING TO THEIR CONFORMATIONAL RIGIDITY, BE USED AS CATALYSTS FOR THE STEREOSPECIFIC POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-08-31 US disclosed
US-20030199703-A1 Method for producing alkyl-bridged ligand systems and transition metal compounds EQUISTAR CHEMICALS, LP 2003-10-23 US disclosed
EP-1313747-A1 METHOD FOR PRODUCING ALKYL-BRIDGED LIGAND SYSTEMS AND TRANSITION METAL COMPOUNDS Basell Polypropylen GmbH (DE) 2003-05-28 EP disclosed
WO-2002018397-A1 METHOD FOR PRODUCING ALKYL-BRIDGED LIGAND SYSTEMS AND TRANSITION METAL COMPOUNDS BASELL POLYPROPYLEN GMBH (DE) 2002-03-07 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 (2 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-20050256344-A1 Preparation of substituted indenes CYP1A2, CYP1B1, DHPS PTAFR 2741/4885TSHR 4583/4885BRD4 2293/4885
US-20030199703-A1 Method for producing alkyl-bridged ligand systems and transition metal compounds ABL1, ICMT, ORAI2 PTAFR 2781/4885TSHR 1526/4885BRD4 64/4885

“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.