SCHEMBL6508273

SCHEMBL6508273

COc1ccccc1Nc1nc2nonc2nc1N/N=C(/C)c1nonc1C

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 5/20 0.49
MEN1 O00255 3/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 9/20 0.39
GAA P10253 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
TP53 P04637 2/20 0.39
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPK1 P28482 1/20 0.36
CDKN1A P38936 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL6417842 1.00 KMT2A (0.49) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL20569973 0.80 ALDH1A1 (0.69) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL21500009 0.75 KMT2A (0.62) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL22542862 0.74 KMT2A (0.60) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL26034948 0.72 POLB (0.56) KMT2AALDH1A1MEN1POLBKDM4E
SCHEMBL13310246 0.71 KMT2A (0.49) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL13310239 0.69 KMT2A (0.47) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL6436752 0.68 KMT2A (0.44) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL22542857 0.68 SMN1; SMN2 (0.53) KMT2AALDH1A1MEN1POLBMAPT
SCHEMBL6419654 0.68 KMT2A (0.43) KMT2AALDH1A1MEN1POLBMAPT

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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds 4SC AG (DE) 2005-06-30 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-20050143382-A1 Heterocyclic compounds as pharmaceutically active compounds NR5A2, NR1H2, NR2C2 KMT2A 3640/4885ALDH1A1 1119/4885MEN1 4392/4885

“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.