SCHEMBL5951668

SCHEMBL5951668

CC1Cc2cccc(-c3ccc(N(C)C)cc3)c2C1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.49
BRD4 O60885 2/20 0.47
CREBBP Q92793 2/20 0.47
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
HTR1A P08908 2/20 0.37
HTR7 P34969 2/20 0.37
HTR2A P28223 1/20 0.37
HTR6 P50406 1/20 0.37
METAP1 P53582 2/20 0.36
DRD2 P14416 1/20 0.36
ABCB1 P08183 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
SCHEMBL5953016 0.86 BRD4 (0.49) ACHEBRD4CREBBPMAOAMAOB
SCHEMBL5951841 0.84 ACHE (0.53) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5952527 0.84 ACHE (0.57) ACHEBRD4CREBBPMAOAMAOB
SCHEMBL5509273 0.83 ACHE (0.61) ACHEBRD4CREBBPMAOAMAOB
SCHEMBL5952120 0.82 ACHE (0.51) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5951988 0.82 ACHE (0.51) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5952093 0.82 ACHE (0.51) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5951497 0.82 ACHE (0.51) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5953400 0.82 ACHE (0.51) ACHEMAOAMAOBHTR1AHTR7
SCHEMBL5951460 0.80 ACHE (0.52) ACHEMAOAMAPTDRD2

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
EP-1066303-B1 TRANSITION METAL COMPOUND CONTAINING CATIONIC GROUPS WHICH IS USED AS AN OLEFIN POLYMERIZATION CATALYST COMPONENT BASELL POLYOLEFINE GMBH (DE) 2003-09-10 EP disclosed
US-6583238-B1 Polypropylene having extraordinarily high stereospecificity and regiospecificity; BASELL POLYOLEFINE GMBH (DE) 2003-06-24 US disclosed
US-6552210-B1 Metallocenes which can be firmly fixed to support; gas phase polymerization TARGOR GMBH (DE) 2003-04-22 US disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 US disclosed
EP-1066330-B1 CATALYST SYSTEM, METHOD FOR THE PRODUCTION THEREOF, AND THE UTILIZATION THEREOF FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2002-02-06 EP disclosed
EP-1066330-A1 CATALYST SYSTEM, METHOD FOR THE PRODUCTION THEREOF, AND THE UTILIZATION THEREOF FOR THE POLYMERIZATION OF OLEFINS Basell Polyolefine GmbH (DE) 2001-01-10 EP disclosed
EP-1066303-A1 TRANSITION METAL COMPOUND CONTAINING CATIONIC GROUPS WHICH IS USED AS AN OLEFIN POLYMERIZATION CATALYST COMPONENT Basell Polyolefine GmbH (DE) 2001-01-10 EP disclosed
EP-0968158-A1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM Basell Polyolefine GmbH (DE) 2000-01-05 EP disclosed
WO-1999050312-A1 CATALYST SYSTEM, METHOD FOR THE PRODUCTION THEREOF, AND THE UTILIZATION THEREOF FOR THE POLYMERIZATION OF OLEFINS TARGOR GMBH (DE) 1999-10-07 WO disclosed
WO-1999050274-A1 TRANSITION METAL COMPOUND CONTAINING CATIONIC GROUPS WHICH IS USED AS AN OLEFIN POLYMERIZATION CATALYST COMPONENT TARGOR GMBH (DE) 1999-10-07 WO disclosed
WO-1998040331-A1 PREPARATION OF PREPARING SUBSTITUTED INDANONES TARGOR GMBH (DE) 1998-09-17 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-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A ACHE 839/4885BRD4 3097/4885CREBBP 2331/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ACHE 820/4885BRD4 3045/4885CREBBP 2466/4885

“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.