SCHEMBL5951568

SCHEMBL5951568

CC(C)C1Cc2cccc(Br)c2C1=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRNP P04156 1/20 0.36
PPARG P37231 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
GRM2 Q14416 2/20 0.34
ACHE P22303 1/20 0.33
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
ABCB1 P08183 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
DRD2 P14416 2/20 0.31
BRD4 O60885 1/20 0.30
PRCP P42785 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
SCHEMBL12225987 0.81 HTR2A (0.43) PRNPPPARGNCOR2MAOAMAOB
SCHEMBL5951595 0.80 TDP2 (0.39) PRNPPPARGNCOR2MAOAMAOB
SCHEMBL4480887 0.80 HTR2A (0.43) PRNPPPARGNCOR2MAOAMAOB
SCHEMBL5951415 0.78 CYBB (0.36) MAOAMAOBACHE
SCHEMBL5951495 0.77 ACHE (0.52) MAOAMAOBACHEABCB1BRD4
SCHEMBL5952596 0.76 HTR1A (0.46) PRNPPPARGNCOR2ACHEHTR2A
SCHEMBL2486074 0.73 PIM1 (0.41) PRNPPPARGNCOR2ACHECA1
SCHEMBL5952655 0.73 METAP1 (0.37) MAOAMAOBACHEHTR2AHTR2C
SCHEMBL5952279 0.73 MAOA (0.37) MAOAMAOBACHECA1CA2
SCHEMBL28586500 0.73 PRNP (0.34) PRNPPPARGNCOR2

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 7 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
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 US 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-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 PRNP 3267/4885PPARG 3654/4885NCOR2 1797/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 PRNP 3542/4885PPARG 3862/4885NCOR2 1919/4885

“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.