SCHEMBL2368227

SCHEMBL2368227

O=S(=O)(c1ccc2c(Cl)c(S(=O)(=O)C(F)(F)F)ccc2c1Cl)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 16/20 0.43
VEGFA P15692 3/20 0.42
CCR2 P41597 1/20 0.37
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL18036960 0.76 EPAS1 (0.52) EPAS1VEGFACCR2MEN1KMT2A
SCHEMBL16555935 0.72 EPAS1 (0.54) EPAS1VEGFA
SCHEMBL6721549 0.70 MEN1 (0.39) EPAS1VEGFAALDH1A1MEN1KMT2A
SCHEMBL30165578 0.70 HSD11B1 (0.51) ALDH1A1MEN1KMT2A
SCHEMBL4433417 0.70 HSD11B1 (0.51) ALDH1A1MEN1KMT2A
SCHEMBL6929900 0.69 CA2 (0.44) CCR2ALDH1A1MEN1KMT2ACA1
SCHEMBL11420060 0.68 HSD17B10 (0.43) EPAS1VEGFAMEN1KMT2A
SCHEMBL2788764 0.68 HSD11B1 (0.51) EPAS1VEGFAALDH1A1CA1CA2
SCHEMBL16555663 0.67 EPAS1 (0.61) EPAS1VEGFA
SCHEMBL12074950 0.65 DRD2 (0.33) EPAS1VEGFACA1CA2

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
EP-2368892-B1 NOVEL COMPOUND, PROCESS FOR PRODUCING THE COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC SEMICONDUCTOR DEVICE UNIV HIROSHIMA (JP) 2014-12-03 EP disclosed
US-8816100-B2 Compound, method of producing the compound, organic semiconductor material and organic semiconductor device HIROSHIMA UNIVERSITY (JP) 2014-08-26 US disclosed
US-20140051865-A1 DESCRIPTION NOVEL COMPUND, METHOD OF PRODUCING THE COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC SEMICONDUCTOR DEVICE HIROSHIMA UNIVERSITY (JP) 2014-02-20 US disclosed
EP-2368892-A1 NOVEL COMPOUND, PROCESS FOR PRODUCING THE COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC SEMICONDUCTOR DEVICE Hiroshima University (JP) 2011-09-28 EP disclosed
US-20110224445-A1 Novel Compound, Method of Producing the Compound, Organic Semiconductor Material and Organic Semiconductor Device HIROSHIMA UNIVERSITY (JP) 2011-09-15 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-20110224445-A1 Novel Compound, Method of Producing the Compound, Organic Semiconductor Material and Organic Semiconductor Device TST, SCLY, SELENOI EPAS1 4335/4885VEGFA 3568/4885CCR2 918/4885

“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.