SCHEMBL3096756

SCHEMBL3096756

OC(c1ccc(I)cc1)(c1ccc(I)cc1)c1ccc(I)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
CYP19A1 P11511 10/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 1/20 0.41
TPMT P51580 1/20 0.38
TRPV1 Q8NER1 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
SLC22A2 O15244 1/20 0.35
SLC22A1 O15245 1/20 0.35
SLC22A3 O75751 1/20 0.35
APP P05067 1/20 0.33

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
SCHEMBL9440477 0.89 CYP19A1 (0.47) SLC2A1CYP19A1TPMT
SCHEMBL6438114 0.82 APP (0.49) CA1CA2APP
SCHEMBL10963 0.77 APP (0.39) SLC2A1TPMTTRPV1CA1CA2
SCHEMBL1986810 0.73 APP (0.40) TPMTTRPV1CA1CA2SLC22A2
SCHEMBL7129323 0.73 APP (0.37) SLC2A1TPMTTRPV1CA1CA2
SCHEMBL5758950 0.73 APP (0.37) TPMTTRPV1SLC22A2SLC22A1SLC22A3
SCHEMBL2857255 0.73 KIF11 (0.42) CYP19A1TPMTAPP
SCHEMBL19224 0.73 NR1H2 (0.56)
SCHEMBL3793827 0.71 ESR1 (0.55) SLC2A1CYP19A1USP2RAB9ACA1
SCHEMBL9050608 0.71 CYP19A1 (0.54) SLC2A1CYP19A1USP2RAB9A

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-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-7799949-B2 Tetraphenylmethane skeleton-containing compound FUJIFILM CORPORATION (JP) 2010-09-21 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 US disclosed
US-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND FUJIFILM CORPORATION (JP) 2009-09-10 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 (1 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-20090227812-A1 TETRAPHENYLMETHANE SKELETON-CONTAINING COMPOUND PAH, TSNAX, ZFX SLC2A1 4456/4885CYP19A1 157/4885USP2 2455/4885

“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.