SCHEMBL14822362

SCHEMBL14822362

CC1(C)OCC(CCC(C)(C)[Si](O)(c2ccccc2)c2ccccc2)(Cn2ccnc2[N+](=O)[O-])CO1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ KMT2A Q03164 2/20 0.33
▸ CA12 O43570 3/20 0.32
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ CA9 Q16790 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TYMP P19971 1/20 0.31
▸ MEN1 O00255 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
SCHEMBL14822359 0.84 — —
SCHEMBL15906625 0.84 — —
SCHEMBL14822354 0.82 — —
SCHEMBL14822358 0.82 — —
SCHEMBL15899125 0.80 CYP3A4 (0.37) CYP3A4CYP2D6OPRK1KMT2ACA12
SCHEMBL14822368 0.79 — —
SCHEMBL14822595 0.77 LMNA (0.43) CYP3A4CYP2D6OPRK1KMT2ACA12
SCHEMBL18589182 0.76 CA12 (0.42) CYP3A4CYP2D6OPRK1KMT2ACA12
SCHEMBL14822522 0.75 ACSS2 (0.30) —
SCHEMBL14822519 0.75 — —

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-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-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
WO-2013042668-A1 RADIOACTIVE FLUORINE LABELED COMPOUND 日本メジフィジックス株式会社 (JP) 2013-03-28 — — 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 (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 CYP3A4 1827/4885CYP2D6 1499/4885OPRK1 1639/4885

“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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