SCHEMBL5952009

SCHEMBL5952009

CC1Cc2c(cccc2-c2ccccc2O)C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.62
CYP19A1 P11511 2/20 0.41
STAT3 P40763 1/20 0.39
BRD4 O60885 1/20 0.38
MAOA P21397 4/20 0.38
MAOB P27338 3/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2A1 P68400 1/20 0.38
PARP1 P09874 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL13115609 0.87 ACHE (0.68) ACHECYP19A1STAT3MAOAMAOB
SCHEMBL5952536 0.85 ACHE (0.57) ACHECYP19A1
SCHEMBL5952316 0.83 ACHE (0.77) ACHEBRD4CSNK2A2CSNK2A1PARP1
SCHEMBL5952877 0.81 ACHE (0.60) ACHEBRD4CSNK2A2CSNK2A1PARP1
SCHEMBL5951704 0.81 ACHE (0.60) ACHEBRD4CSNK2A2CSNK2A1
SCHEMBL3066323 0.81 ACHE (0.64) ACHEBRD4
SCHEMBL5952061 0.80 ACHE (0.58) ACHECYP19A1MAOAMAOBKDM4E
SCHEMBL3150632 0.80 ACHE (0.58) ACHEBRD4MAOAMAOBALDH1A1
SCHEMBL5952898 0.79 ACHE (0.57) ACHECYP19A1STAT3MAOAMAOB
SCHEMBL5952092 0.79 ACHE (0.82) ACHECYP19A1KDM4ELMNAMAPT

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 5 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

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 839/4885CYP19A1 18/4885STAT3 4523/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ACHE 820/4885CYP19A1 17/4885STAT3 4558/4885

“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.