SCHEMBL18154877

SCHEMBL18154877

COC(=O)CNc1c(F)c(F)nc(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
GAA P10253 1/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 3/20 0.38
MAPK1 P28482 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
SCHEMBL19890993 0.81 MEN1 (0.50) KMT2AMEN1MAPTHTTTSHR
SCHEMBL19876831 0.79 MAPT (0.52) KMT2AMEN1MAPTHTTCA12
SCHEMBL22905163 0.77 MEN1 (0.50) KMT2AMEN1MAPTHTTGAA
SCHEMBL18451634 0.72 GAA (0.39) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL1871683 0.71 GAA (0.59) KMT2AMEN1HTTGAACA12
SCHEMBL9779930 0.70 SMN1; SMN2 (0.50) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL6162575 0.67 CXCR1 (0.40) KMT2AMEN1MAPTHTTCA12
SCHEMBL23309599 0.66 KDM4E (0.44) KMT2AMEN1MAPTGAASMN1; SMN2
SCHEMBL31115168 0.66 HTT (0.46) KMT2AMEN1MAPTHTTTSHR
SCHEMBL25585997 0.66 KDM4E (0.40) KMT2AMEN1MAPTGAACA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11247973-B2 Antiviral benzodiazepine compounds THE UNIVERSITY OF DURHAM (GB) 2022-02-15 US disclosed
US-11247973-B2 Antiviral benzodiazepine compounds THE UNIVERSITY OF DURHAM (GB) 2022-02-15 US disclosed
EP-3497096-B1 AN ANTIMICROBIAL COMPOUND THE UNIV OF DURHAM (GB) 2021-11-10 EP disclosed
EP-3497096-B1 AN ANTIMICROBIAL COMPOUND THE UNIV OF DURHAM (GB) 2021-11-10 EP disclosed
US-20210017138-A1 An Antimicrobial Compound THE UNIVERSITY OF DURHAM (GB) 2021-01-21 US disclosed
US-20210017138-A1 An Antimicrobial Compound THE UNIVERSITY OF DURHAM (GB) 2021-01-21 US disclosed
US-10406166-B2 Antimicrobial compound THE UNIVERSITY OF DURHAM (GB) 2019-09-10 US disclosed
EP-3497096-A1 AN ANTIMICROBIAL COMPOUND The University of Durham (GB) 2019-06-19 EP disclosed
WO-2018033714-A1 AN ANTIMICROBIAL COMPOUND THE UNIVERSITY OF DURHAM (GB) 2018-02-22 WO disclosed
WO-2018033714-A1 AN ANTIMICROBIAL COMPOUND THE UNIVERSITY OF DURHAM (GB) 2018-02-22 WO disclosed
EP-3283170-A1 AN ANTIMICROBIAL COMPOUND The University of Durham (GB) 2018-02-21 EP disclosed
WO-2016166546-A1 AN ANTIMICROBIAL COMPOUND THE UNIVERSITY OF DURHAM (GB) 2016-10-20 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 (3 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-10406166-B2 Antimicrobial compound FPR1, MPO, NISCH KMT2A 4568/4885MEN1 1193/4885MAPT 3105/4885
US-11247973-B2 Antiviral benzodiazepine compounds GABRA5, GABRA1, GABRA6 KMT2A 1789/4885MEN1 2946/4885MAPT 1716/4885
US-20210017138-A1 An Antimicrobial Compound FPR1, CFTR, FPR2 KMT2A 4643/4885MEN1 1441/4885MAPT 3322/4885

“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.