SCHEMBL5952408

SCHEMBL5952408

CC[Sn](C)(c1ccccc1)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
TAAR1 Q96RJ0 2/20 0.32
SLC6A2 P23975 1/20 0.32
TSHR P16473 2/20 0.31
KCNN4 O15554 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPK1 P28482 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
SCHEMBL9746278 0.71 TP53 (0.32) TP53TAAR1SLC6A2KCNN4
SCHEMBL9745740 0.71 ALDH1A1 (0.33) TP53TAAR1SLC6A2TSHRKCNN4
SCHEMBL25355509 0.67 TP53 (0.48) TP53TSHRKCNN4ALDH1A1LMNA
SCHEMBL31352841 0.67 ALDH1A1 (0.37) TAAR1SLC6A2TSHRKCNN4ALDH1A1
SCHEMBL31558571 0.67 MAPK1 (0.42) TAAR1TSHRKCNN4ALDH1A1KMT2A
SCHEMBL1029950 0.67 TP53 (0.41) TP53TSHRKCNN4ALDH1A1LMNA
SCHEMBL1031778 0.67 TP53 (0.41) TP53TSHRKCNN4ALDH1A1LMNA
SCHEMBL898908 0.67 TP53 (0.48) TP53TSHRKCNN4ALDH1A1LMNA
SCHEMBL9747213 0.67 TP53 (0.36) TP53TSHRLMNA
SCHEMBL9746969 0.67 TP53 (0.36) TP53TSHRALDH1A1LMNA

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 TP53 1101/4885TAAR1 3746/4885SLC6A2 4252/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 TP53 1187/4885TAAR1 3272/4885SLC6A2 4372/4885

“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.