SCHEMBL6103705

SCHEMBL6103705

[CH2]Cc1cc(I)c(O)c(I)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 4/20 0.50
ALB P02768 1/20 0.41
THRB P10828 4/20 0.39
PPARG P37231 4/20 0.39
THRA P10827 3/20 0.39
RXRA P19793 2/20 0.39
ITGB3 P05106 1/20 0.39
ITGAV P06756 1/20 0.39
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 1/20 0.38
SIRT5 Q9NXA8 1/20 0.37
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
TBXA2R P21731 2/20 0.35
ADRB2 P07550 1/20 0.35
CHEK1 O14757 1/20 0.34
DAPK3 O43293 1/20 0.34

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
SCHEMBL28129197 0.84 HSD17B10 (0.36) TTRTHRBPPARGTHRARXRA
SCHEMBL28129730 0.84 CHEK1 (0.46) TTRALBTHRBPPARGTHRA
SCHEMBL8773696 0.76 TTR (0.52) TTRALBTHRBPPARGTHRA
SCHEMBL1126255 0.76 TTR (0.52) TTRALBTHRBPPARGTHRA
SCHEMBL10551451 0.74 CA1 (0.50) TTRMEN1KMT2ALMNACYP2C9
SCHEMBL6104943 0.73 THRB (0.40) THRBPPARGTHRARXRAMEN1
SCHEMBL8961865 0.73 XDH (0.47) TTRALBPPARGRXRAMEN1
SCHEMBL3205151 0.72 SELP (0.41) LMNAHTTCYP2C9HIF1AADRB2
SCHEMBL12514479 0.72 TTR (0.48) TTRALBTHRBPPARGTHRA
SCHEMBL8773681 0.72 TTR (0.48) TTRALBTHRBPPARGTHRA

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-20060004062-A1 Compounds for inhibiting insulin secretion and methods related thereto MITOKOR (US) 2006-01-05 US disclosed
US-6958352-B2 Compounds for inhibiting insulin secretion and methods related thereto SMITHKLINE BEECHAM CORPORATION (US) 2005-10-25 US disclosed
EP-1472214-A2 COMPOUNDS FOR INHIBITING INSULIN SECRETION AND METHODS RELATED THERETO SmithKline Beecham Corporation (US) 2004-11-03 EP disclosed
US-20040044049-A1 Compounds for inhibiting insulin secretion and methods related thereto MITOKOR 2004-03-04 US disclosed
WO-2003066035-A2 COMPOUNDS FOR INHIBITING INSULIN SECRETION AND METHODS RELATED THERETO SMITHKLINE BEECHAM CORPORATION (US) 2003-08-14 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-20060004062-A1 Compounds for inhibiting insulin secretion and methods related thereto IAPP, GPR119, INSR TTR 2355/4885ALB 3816/4885THRB 67/4885
US-20040044049-A1 Compounds for inhibiting insulin secretion and methods related thereto IAPP, GPR119, IRS1 TTR 3128/4885ALB 4174/4885THRB 78/4885

“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.