SCHEMBL16375311

SCHEMBL16375311

O=C(Cn1c([N+](=O)[O-])cnc1CF)NCC(F)(F)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.41
▸ EGFR P00533 5/20 0.40
▸ ERBB2 P04626 5/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL15607884 0.91 MEN1 (0.46) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15607885 0.88 MEN1 (0.47) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15544812 0.85 MEN1 (0.61) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL16375306 0.83 EGFR (0.41) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15607889 0.81 MEN1 (0.46) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15607890 0.79 MEN1 (0.47) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL16375307 0.79 EGFR (0.49) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL16374963 0.79 MEN1 (0.36) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15545029 0.75 MEN1 (0.64) MEN1KMT2AKDM4EEGFRERBB2
SCHEMBL15544312 0.75 MEN1 (0.38) MEN1KMT2AKDM4ESMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation AUCKLAND UNISERVICES LTD (NL) 2015-01-08 — — 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-20150010474-A1 Compounds And Methods For Selective Imaging And/Or Ablation CBR1, CBR3, BLVRB MEN1 2288/4885KMT2A 2366/4885KDM4E 1607/4885

“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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