SCHEMBL4852389

SCHEMBL4852389

C[Si](C)(C)c1cc(Br)ccc1S(=O)(=O)n1ccc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
PKM P14618 1/20 0.57
FABP4 P15090 4/20 0.50
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAPGEF4 Q8WZA2 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTR6 P50406 8/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
FABP3 P05413 1/20 0.43
FABP2 P12104 1/20 0.43
FABP5 Q01469 1/20 0.43
ACLY P53396 1/20 0.40
CHRM1 P11229 1/20 0.39

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
SCHEMBL4862697 0.73 HTT (1.00) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL3427594 0.73 HTT (0.62) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL946378 0.73 HTR6 (0.59) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL9270506 0.72 HTT (0.70) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL4455631 0.72 HTT (0.58) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL675295 0.72 FABP4 (0.53) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL28003540 0.70 HTT (0.63) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL4456191 0.69 HTT (0.58) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL3526978 0.68 HTR6 (0.68) HTTMEN1KMT2AL3MBTL1PKM
SCHEMBL34460046 0.68 HTR6 (0.68) HTTMEN1KMT2AL3MBTL1PKM

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090860-A1 Retinoid x receptor modulators GARDINIER KEVIN M 2008-04-17 US disclosed
US-7348359-B2 Retinoid X receptor modulators ELI LILLY AND COMPANY (US) 2008-03-25 US disclosed
EP-1373240-B1 RETINOID X RECEPTOR MODULATORS LILLY CO ELI (US) 2005-06-15 EP disclosed
US-20040167160-A1 Retinoid x receptor modulators LIGAND PHARMACEUTICALS INCORPORATED 2004-08-26 US disclosed
EP-1373240-A2 RETINOID X RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-01-02 EP disclosed
WO-2002071827-A2 RETINOID X RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2002-09-19 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-20040167160-A1 Retinoid x receptor modulators RXRA, RXRG, RXRB HTT 3480/4885MEN1 4117/4885KMT2A 4050/4885
US-20080090860-A1 Retinoid x receptor modulators RXRA, RXRG, RXRB HTT 3569/4885MEN1 4261/4885KMT2A 4112/4885

“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.