SCHEMBL24379893

SCHEMBL24379893

COC(O)c1ccc(-n2cc(N)c(C(N)=O)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 2/20 0.39
ALDH1A1 P00352 7/20 0.39
GAA P10253 2/20 0.39
PARP1 P09874 1/20 0.37
PARP2 Q9UGN5 1/20 0.37
PARP3 Q9Y6F1 1/20 0.37
NPC1 O15118 9/20 0.37
RAB9A P51151 8/20 0.37
KDM4E B2RXH2 6/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
KMT2A Q03164 4/20 0.34

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
SCHEMBL6468659 0.78 ALDH1A1 (0.47) MAPKAPK2ALDH1A1GAANPC1RAB9A
Ammonia Solution, Strong SCHEMBL21070052 0.77 ALDH1A1 (0.46) MAPKAPK2ALDH1A1GAANPC1RAB9A
SCHEMBL26351653 0.76 KCNJ1 (0.50) MAPKAPK2ALDH1A1GAANPC1RAB9A
SCHEMBL6505228 0.76 KDM4E (0.55) ALDH1A1GAAPARP1PARP2PARP3
SCHEMBL6470229 0.76 CA9 (0.47) MAPKAPK2ALDH1A1GAAPARP1PARP2
SCHEMBL3568441 0.75 ALDH1A1 (0.54) ALDH1A1GAAPARP1PARP2PARP3
SCHEMBL21070649 0.73 ALDH1A1 (0.40) MAPKAPK2ALDH1A1GAAPARP1PARP2
SCHEMBL12800605 0.72 RAB9A (0.55) MAPKAPK2ALDH1A1GAAPARP1NPC1
SCHEMBL21070060 0.72 MAPK1 (0.44) MAPKAPK2ALDH1A1GAANPC1RAB9A
SCHEMBL21069440 0.71 NPC1 (0.43) ALDH1A1GAAPARP1NPC1RAB9A

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-11318205-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-05-03 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-11318205-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 MAPKAPK2 714/4885ALDH1A1 2776/4885GAA 1234/4885

“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.