SCHEMBL25822252

SCHEMBL25822252

O=C(Nc1cc(Oc2ccncc2)ccn1)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 3/20 0.60
KMT2A Q03164 2/20 0.59
POLB P06746 1/20 0.57
CACNA1B Q00975 1/20 0.57
APBA1 Q02410 1/20 0.57
GRM5 P41594 6/20 0.56
HPGD P15428 1/20 0.55
ATM Q13315 1/20 0.55
MAPT P10636 2/20 0.54
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
BRAF P15056 1/20 0.53
MEN1 O00255 1/20 0.53
FFAR1 O14842 1/20 0.52
ALDH1A1 P00352 2/20 0.52
KDR P35968 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL25822329 0.93 MAPT (0.62) SMN1; SMN2LMNAKMT2AGRM5MAPT
SCHEMBL25822301 0.89 KMT2A (0.57) SMN1; SMN2LMNAKMT2AGRM5MAPT
SCHEMBL25821902 0.85 LMNA (0.70) SMN1; SMN2LMNAKMT2APOLBCACNA1B
SCHEMBL24010267 0.81 GRM5 (0.60) SMN1; SMN2LMNAGRM5RAB9ANPC1
SCHEMBL24010268 0.81 GRM5 (0.59) LMNAGRM5BRAF
SCHEMBL30290826 0.81 GRM5 (0.59) LMNAGRM5BRAF
SCHEMBL25822054 0.80 KMT2A (0.66) SMN1; SMN2LMNAKMT2APOLBCACNA1B
SCHEMBL16963464 0.80 KMT2A (0.69) SMN1; SMN2LMNAKMT2APOLBCACNA1B
SCHEMBL10090737 0.78 ALDH1A1 (0.78) SMN1; SMN2LMNAKMT2APOLBCACNA1B
SCHEMBL7743046 0.78 KMT2A (0.81) SMN1; SMN2LMNAKMT2APOLBCACNA1B

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 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-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA SMN1; SMN2 2169/4885LMNA 2015/4885KMT2A 4131/4885

“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.