SCHEMBL6852077

SCHEMBL6852077

CCCCCC(C)(C)c1cc(Oc2c(I)cc(C(=O)O)cc2I)cc(I)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.46
THRA P10827 7/20 0.46
PPARG P37231 5/20 0.46
RXRA P19793 3/20 0.46
ITGB3 P05106 1/20 0.46
ITGAV P06756 1/20 0.46
LMNA P02545 4/20 0.42
HSD17B10 Q99714 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ADORA3 P0DMS8 3/20 0.42
PDE4D Q08499 3/20 0.42
TTR P02766 2/20 0.42
CYP1A2 P05177 2/20 0.42
HTR1A P08908 2/20 0.42
CYP2C9 P11712 2/20 0.42
HTR2B P41595 2/20 0.42
PGR P06401 2/20 0.42
USP2 O75604 2/20 0.42
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL9522943 0.79 THRB (0.64) THRBTHRAPPARGRXRAITGB3
SCHEMBL11366610 0.78 PLA2G2A (0.44) LMNAHSD17B10MEN1KMT2AALDH1A1
SCHEMBL29119733 0.76 PLA2G2A (0.46) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL6852139 0.75 THRB (0.45) THRBTHRAPPARGRXRAITGB3
SCHEMBL15524546 0.74 KDM4E (0.46) LMNAHSD17B10MEN1KMT2AALDH1A1
SCHEMBL7796156 0.74 LMNA (0.48) LMNAKMT2APTGS2PLA2G2ASMN1; SMN2
SCHEMBL3809013 0.73 ESR1 (0.43) MEN1KMT2AMAPTESR1PLA2G2A
SCHEMBL3809058 0.73 PLA2G2A (0.40) MEN1KMT2AALDH1A1ESR1PLA2G2A
SCHEMBL6723520 0.71 TP53 (0.57) NR1H4PLA2G2ATSHR
SCHEMBL11779397 0.69 CNR1 (0.40) PLA2G2ACNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580395-B2 Compositions of dual thyrointegrin antagonists and use in vascular-associated disorders VASCULAR VISION PHARMACEUTICAL COMPANY (US) 2017-02-28 US disclosed
US-20150031688-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS NANOPHARMACEUTICALS, LLC 2015-01-29 US disclosed
US-8859539-B2 Compositions of dual thyrointegrin antagonists and use in vascular-associated disorders VASCULAR VISION PHARMACEUTICAL COMPANY (US) 2014-10-14 US disclosed
US-20110105482-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS VASCULAR VISION PHARMACEUTICAL COMPANY (US) 2011-05-05 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-20150031688-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS TEK, THRA, TSHR THRB 4/4885THRA 2/4885PPARG 449/4885
US-20110105482-A1 COMPOSITIONS OF DUAL THYROINTEGRIN ANTAGONISTS AND USE IN VASCULAR-ASSOCIATED DISORDERS TEK, THRA, TSHR THRB 4/4885THRA 2/4885PPARG 449/4885

“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.