SCHEMBL21499795

SCHEMBL21499795

Oc1nc2nonc2nc1Nc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.54
TP53 P04637 7/20 0.54
SMN1; SMN2 Q16637 7/20 0.54
POLB P06746 2/20 0.54
GAA P10253 5/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
HTT P42858 3/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RAB9A P51151 3/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.39
CCR2 P41597 1/20 0.39
CCR5 P51681 1/20 0.39
ALK Q9UM73 1/20 0.38
EGFR P00533 1/20 0.38
KDR P35968 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
SCHEMBL3050870 0.88 SMN1; SMN2 (0.65) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21499877 0.84 GAA (0.66) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21497112 0.84 SMN1; SMN2 (0.56) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21499903 0.84 GAA (0.47) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21499915 0.83 GAA (0.45) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL3058473 0.83 MAPT (0.48) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21497180 0.82 TP53 (0.54) MAPTTP53SMN1; SMN2POLBCCR2
SCHEMBL21499889 0.81 EPHX2 (0.50) MAPTTP53SMN1; SMN2POLBGAA
SCHEMBL21499912 0.81 GAA (0.48) MAPTTP53SMN1; SMN2GAARECQL
SCHEMBL17249531 0.81 GAA (0.66) MAPTTP53SMN1; SMN2POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023159248-A1 RE-SENSITIZING MULTIDRUG-RESISTANT (MDR) GRAM-NEGATIVE BACTERIA TO COLISTIN USING IONOPHORES THE REGENTS OF THE UNIVERSITY OF COLORADO A BODY CORPORATE (US) 2023-08-24 WO disclosed
US-20210253594-A1 OXADIAZOLOPYRAZINES AND OXADIAZOLOPYRIDINES USEFUL AS MITOCHONDRIAL UNCOUPLERS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2021-08-19 US disclosed
US-20210253594-A1 OXADIAZOLOPYRAZINES AND OXADIAZOLOPYRIDINES USEFUL AS MITOCHONDRIAL UNCOUPLERS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2021-08-19 US disclosed
WO-2019204813-A1 OXADIAZOLOPYRAZINES AND OXADIAZOLOPYRIDINES USEFUL AS MITOCHONDRIAL UNCOUPLERS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2019-10-24 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-20210253594-A1 OXADIAZOLOPYRAZINES AND OXADIAZOLOPYRIDINES USEFUL AS MITOCHONDRIAL UNCOUPLERS NDUFAF1, OXA1L, GLS2 MAPT 4454/4885TP53 2822/4885SMN1; SMN2 323/4885

“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.