SCHEMBL5952652

SCHEMBL5952652

CC1Cc2c(cccc2[Sn](c2ccccc2)(c2ccccc2)c2ccccc2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.57
CSNK2A2 P19784 1/20 0.33
CSNK2A1 P68400 1/20 0.33
TSHR P16473 1/20 0.32
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
S100A4 P26447 1/20 0.31
CYP19A1 P11511 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HTR2B P41595 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
SCHEMBL5951096 0.82 ACHE (0.62) ACHECSNK2A2CSNK2A1TSHRBRD4
SCHEMBL3066323 0.77 ACHE (0.64) ACHEBRD4CREBBP
SCHEMBL5951779 0.75 ACHE (0.49) ACHETSHRBRD4CREBBP
SCHEMBL5951704 0.74 ACHE (0.60) ACHECSNK2A2CSNK2A1BRD4CREBBP
SCHEMBL5952058 0.74 ACHE (0.60) ACHEBRD4CREBBP
SCHEMBL5953178 0.74 ACHE (0.51) ACHECYP19A1
SCHEMBL6936179 0.73 ACHE (1.00) ACHECREBBPHTR2B
SCHEMBL30666460 0.73 ACHE (1.00) ACHECREBBPHTR2B
SCHEMBL13115609 0.73 ACHE (0.68) ACHETSHRCYP19A1LMNAMAPT
SCHEMBL5952009 0.72 ACHE (0.62) ACHECSNK2A2CSNK2A1TSHRBRD4

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 839/4885CSNK2A2 217/4885CSNK2A1 224/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ACHE 820/4885CSNK2A2 260/4885CSNK2A1 236/4885

“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.