SCHEMBL5952555

SCHEMBL5952555

C=Cc1ccccc1[Sn](C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.35
HDAC8 Q9BY41 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL3469282 0.76 LMNA (0.55) ALDH1A1TSHRMEN1LMNATHRB
Ethane SCHEMBL29266735 0.73 ALDH1A1 (0.57) ALDH1A1TSHRHDAC8MEN1LMNA
SCHEMBL29405187 0.73 ALDH1A1 (0.63) ALDH1A1TSHRHDAC8MEN1LMNA
SCHEMBL7638 0.73 ALDH1A1 (0.63) ALDH1A1TSHRHDAC8MEN1LMNA
SCHEMBL473080 0.73 ALDH1A1 (0.63) ALDH1A1TSHRHDAC8MEN1LMNA
SCHEMBL8678832 0.73 TSHR (0.35) TSHRLMNA
SCHEMBL7684858 0.71 ALDH1A1 (0.40) ALDH1A1TSHR
Propene SCHEMBL7948571 0.71 ALDH1A1 (0.55) ALDH1A1TSHRHDAC8MEN1LMNA
Methyl Alcohol SCHEMBL28639807 0.71 ALDH1A1 (0.55) ALDH1A1TSHRHDAC8MEN1LMNA
SCHEMBL6400185 0.70 ALDH1A1 (0.35) ALDH1A1

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-1066329-A1 POLYMERIC SUPPORTED CATALYSTS FOR OLEFIN POLYMERIZATION EXXON CHEMICAL PATENTS INC. (US) 2001-01-10 EP disclosed
WO-1999050311-A1 POLYMERIC SUPPORTED CATALYSTS FOR OLEFIN POLYMERIZATION EXXON CHEMICAL PATENTS INC. (US) 1999-10-07 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-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A ALDH1A1 317/4885TSHR 4624/4885HDAC8 3820/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 ALDH1A1 198/4885TSHR 4667/4885HDAC8 3917/4885

“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.