SCHEMBL15899140

SCHEMBL15899140

Cc1ccc(S(=O)(=O)OCC2(CCn3ccnc3[N+](=O)[O-])COC(C)(C)OC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.41
▸ CA1 P00915 5/20 0.41
▸ CA2 P00918 5/20 0.41
▸ CA9 Q16790 5/20 0.41
▸ KMT2A Q03164 2/20 0.32
▸ CCR10 P46092 2/20 0.31
▸ TYMP P19971 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ HSP90AA1 P07900 1/20 0.30
▸ CXCR5 P32302 1/20 0.30
▸ APLNR P35414 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ CCR6 P51684 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ NOS1 P29475 1/20 0.30

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
SCHEMBL14822353 0.92 CA12 (0.39) CA12CA1CA2CA9KMT2A
SCHEMBL18589129 0.82 CA12 (0.38) CA12CA1CA2CA9KMT2A
SCHEMBL16285938 0.81 CA12 (0.41) CA12CA1CA2CA9KMT2A
SCHEMBL18633388 0.80 CA12 (0.39) CA12CA1CA2CA9KMT2A
SCHEMBL15899355 0.79 CA12 (0.44) CA12CA1CA2CA9KMT2A
SCHEMBL14822596 0.79 CA12 (0.44) CA12CA1CA2CA9KMT2A
SCHEMBL28634383 0.79 CA12 (0.49) CA12CA1CA2CA9KMT2A
SCHEMBL29705195 0.76 CA12 (0.37) CA12CA1CA2CA9KMT2A
SCHEMBL10047554 0.76 STAT3 (0.37) CA12CA1CA2CA9KMT2A
SCHEMBL27794804 0.75 CA12 (0.46) CA12CA1CA2CA9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2759538-B1 RADIOACTIVE FLUORINE LABELED COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2016-03-23 — — EP disclosed
EP-2759538-B1 RADIOACTIVE FLUORINE LABELED COMPOUND NIHON MEDIPHYSICS CO LTD (JP) 2016-03-23 — — EP disclosed
US-9107964-B2 Radioactive fluorine-labeled compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2015-08-18 — — US disclosed
US-9107964-B2 Radioactive fluorine-labeled compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2015-08-18 — — US disclosed
US-20140364620-A1 RADIOACTIVE FLUORINE-LABELED COMPOUND NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2014-12-11 — — US disclosed
US-20140364620-A1 RADIOACTIVE FLUORINE-LABELED COMPOUND NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2014-12-11 — — US disclosed
EP-2759538-A1 RADIOACTIVE FLUORINE LABELED COMPOUND Nihon Medi-Physics Co., Ltd. (JP) 2014-07-30 — — EP disclosed
EP-2759538-A1 RADIOACTIVE FLUORINE LABELED COMPOUND Nihon Medi-Physics Co., Ltd. (JP) 2014-07-30 — — EP 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-20140364620-A1 RADIOACTIVE FLUORINE-LABELED COMPOUND AFF1, PRMT1, DOT1L CA12 1215/4885CA1 667/4885CA2 2376/4885

“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.

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